USER MOD reduce.3.24.130724 H: found=0, std=0, add=590, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 498 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 121 MET CE :methyl -144:sc= -0.615 (180deg=-2.29!) USER MOD Set 1.2: A 123 MET CE :methyl -97:sc= -0.0879 (180deg=0) USER MOD Set 1.3: A 125 ASN : amide:sc= -1.09 K(o=-1.8,f=-7.6!) USER MOD Single : A 81 HIS : no HD1:sc= -2.06! C(o=-2.1!,f=-5.6!) USER MOD Single : A 85 SER OG : rot 81:sc= 0.319 USER MOD Single : A 87 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 ASN : amide:sc= -1.57 X(o=-1.6,f=-1.8!) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 CYS SG : rot 142:sc= -1.4! USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 MET CE :methyl 167:sc= -0.0109 (180deg=-0.325) USER MOD Single : A 126 GLN : amide:sc= -0.025 X(o=-0.025,f=-0.018) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 SER OG : rot 43:sc= 1.1 USER MOD Single : A 144 GLN : amide:sc= -1.27 K(o=-1.3,f=-8.7!) USER MOD ----------------------------------------------------------------- ATOM 130 N HIS A 81 -5.740 8.132 2.740 1.00 1.00 N ATOM 131 CA HIS A 81 -5.757 6.788 3.292 1.00 1.00 C ATOM 132 C HIS A 81 -4.361 6.423 3.798 1.00 1.00 C ATOM 133 O HIS A 81 -3.370 7.029 3.389 1.00 1.00 O ATOM 134 CB HIS A 81 -6.298 5.786 2.270 1.00 1.00 C ATOM 135 CG HIS A 81 -6.398 4.372 2.789 1.00 1.00 C ATOM 136 ND1 HIS A 81 -6.773 4.075 4.088 1.00 1.00 N ATOM 137 CD2 HIS A 81 -6.168 3.177 2.172 1.00 1.00 C ATOM 138 CE1 HIS A 81 -6.766 2.759 4.234 1.00 1.00 C ATOM 139 NE2 HIS A 81 -6.389 2.204 3.046 1.00 1.00 N ATOM 0 HA HIS A 81 -6.436 6.751 4.144 1.00 1.00 H new ATOM 0 HB2 HIS A 81 -7.285 6.113 1.944 1.00 1.00 H new ATOM 0 HB3 HIS A 81 -5.653 5.795 1.391 1.00 1.00 H new ATOM 0 HD2 HIS A 81 -5.858 3.046 1.146 1.00 1.00 H new ATOM 0 HE1 HIS A 81 -7.015 2.219 5.136 1.00 1.00 H new ATOM 0 HE2 HIS A 81 -6.293 1.206 2.861 1.00 1.00 H new ATOM 146 N ILE A 82 -4.324 5.436 4.680 1.00 1.00 N ATOM 147 CA ILE A 82 -3.065 4.983 5.247 1.00 1.00 C ATOM 148 C ILE A 82 -3.087 3.458 5.373 1.00 1.00 C ATOM 149 O ILE A 82 -3.960 2.899 6.036 1.00 1.00 O ATOM 150 CB ILE A 82 -2.780 5.705 6.565 1.00 1.00 C ATOM 151 CG1 ILE A 82 -2.894 7.221 6.395 1.00 1.00 C ATOM 152 CG2 ILE A 82 -1.421 5.293 7.133 1.00 1.00 C ATOM 153 CD1 ILE A 82 -1.718 7.772 5.585 1.00 1.00 C ATOM 0 H ILE A 82 -5.147 4.936 5.017 1.00 1.00 H new ATOM 0 HA ILE A 82 -2.236 5.237 4.586 1.00 1.00 H new ATOM 0 HB ILE A 82 -3.536 5.404 7.290 1.00 1.00 H new ATOM 0 HG12 ILE A 82 -3.831 7.465 5.894 1.00 1.00 H new ATOM 0 HG13 ILE A 82 -2.922 7.699 7.374 1.00 1.00 H new ATOM 0 HG21 ILE A 82 -1.243 5.821 8.070 1.00 1.00 H new ATOM 0 HG22 ILE A 82 -1.413 4.218 7.315 1.00 1.00 H new ATOM 0 HG23 ILE A 82 -0.637 5.546 6.420 1.00 1.00 H new ATOM 0 HD11 ILE A 82 -1.823 8.852 5.479 1.00 1.00 H new ATOM 0 HD12 ILE A 82 -0.784 7.548 6.101 1.00 1.00 H new ATOM 0 HD13 ILE A 82 -1.708 7.310 4.598 1.00 1.00 H new ATOM 164 N VAL A 83 -2.116 2.828 4.727 1.00 1.00 N ATOM 165 CA VAL A 83 -2.013 1.380 4.760 1.00 1.00 C ATOM 166 C VAL A 83 -1.187 0.958 5.977 1.00 1.00 C ATOM 167 O VAL A 83 -0.003 1.283 6.070 1.00 1.00 O ATOM 168 CB VAL A 83 -1.436 0.867 3.438 1.00 1.00 C ATOM 169 CG1 VAL A 83 -1.351 -0.661 3.434 1.00 1.00 C ATOM 170 CG2 VAL A 83 -2.255 1.374 2.250 1.00 1.00 C ATOM 0 H VAL A 83 -1.394 3.295 4.178 1.00 1.00 H new ATOM 0 HA VAL A 83 -3.000 0.929 4.866 1.00 1.00 H new ATOM 0 HB VAL A 83 -0.424 1.259 3.339 1.00 1.00 H new ATOM 0 HG11 VAL A 83 -0.938 -1.000 2.484 1.00 1.00 H new ATOM 0 HG12 VAL A 83 -0.707 -0.992 4.248 1.00 1.00 H new ATOM 0 HG13 VAL A 83 -2.348 -1.081 3.567 1.00 1.00 H new ATOM 0 HG21 VAL A 83 -1.824 0.995 1.323 1.00 1.00 H new ATOM 0 HG22 VAL A 83 -3.283 1.025 2.341 1.00 1.00 H new ATOM 0 HG23 VAL A 83 -2.242 2.464 2.238 1.00 1.00 H new ATOM 180 N ARG A 84 -1.842 0.242 6.878 1.00 1.00 N ATOM 181 CA ARG A 84 -1.182 -0.226 8.084 1.00 1.00 C ATOM 182 C ARG A 84 -1.061 -1.751 8.065 1.00 1.00 C ATOM 183 O ARG A 84 -2.060 -2.455 7.924 1.00 1.00 O ATOM 184 CB ARG A 84 -1.953 0.202 9.335 1.00 1.00 C ATOM 185 CG ARG A 84 -2.052 1.726 9.424 1.00 1.00 C ATOM 186 CD ARG A 84 -2.002 2.194 10.879 1.00 1.00 C ATOM 187 NE ARG A 84 -3.353 2.603 11.325 1.00 1.00 N ATOM 188 CZ ARG A 84 -3.857 3.846 11.174 1.00 1.00 C ATOM 189 NH1 ARG A 84 -3.124 4.815 10.586 1.00 1.00 N ATOM 190 NH2 ARG A 84 -5.077 4.100 11.611 1.00 1.00 N ATOM 0 H ARG A 84 -2.823 -0.026 6.797 1.00 1.00 H new ATOM 0 HA ARG A 84 -0.188 0.220 8.113 1.00 1.00 H new ATOM 0 HB2 ARG A 84 -2.953 -0.230 9.316 1.00 1.00 H new ATOM 0 HB3 ARG A 84 -1.455 -0.186 10.224 1.00 1.00 H new ATOM 0 HG2 ARG A 84 -1.235 2.180 8.864 1.00 1.00 H new ATOM 0 HG3 ARG A 84 -2.981 2.061 8.962 1.00 1.00 H new ATOM 0 HD2 ARG A 84 -1.627 1.392 11.515 1.00 1.00 H new ATOM 0 HD3 ARG A 84 -1.309 3.029 10.977 1.00 1.00 H new ATOM 0 HE ARG A 84 -3.940 1.901 11.775 1.00 1.00 H new ATOM 0 HH11 ARG A 84 -2.182 4.610 10.252 1.00 1.00 H new ATOM 0 HH12 ARG A 84 -3.512 5.752 10.476 1.00 1.00 H new ATOM 0 HH21 ARG A 84 -5.624 3.362 12.055 1.00 1.00 H new ATOM 0 HH22 ARG A 84 -5.473 5.034 11.505 1.00 1.00 H new ATOM 199 N SER A 85 0.171 -2.217 8.210 1.00 1.00 N ATOM 200 CA SER A 85 0.435 -3.646 8.211 1.00 1.00 C ATOM 201 C SER A 85 -0.516 -4.353 9.179 1.00 1.00 C ATOM 202 O SER A 85 -0.353 -4.258 10.395 1.00 1.00 O ATOM 203 CB SER A 85 1.889 -3.938 8.587 1.00 1.00 C ATOM 204 OG SER A 85 2.036 -5.214 9.202 1.00 1.00 O ATOM 0 H SER A 85 0.997 -1.630 8.328 1.00 1.00 H new ATOM 0 HA SER A 85 0.266 -4.025 7.203 1.00 1.00 H new ATOM 0 HB2 SER A 85 2.511 -3.893 7.693 1.00 1.00 H new ATOM 0 HB3 SER A 85 2.250 -3.165 9.265 1.00 1.00 H new ATOM 0 HG SER A 85 2.067 -5.908 8.511 1.00 1.00 H new ATOM 209 N PRO A 86 -1.513 -5.065 8.588 1.00 1.00 N ATOM 210 CA PRO A 86 -2.489 -5.790 9.385 1.00 1.00 C ATOM 211 C PRO A 86 -1.881 -7.063 9.974 1.00 1.00 C ATOM 212 O PRO A 86 -2.559 -7.815 10.672 1.00 1.00 O ATOM 213 CB PRO A 86 -3.644 -6.066 8.435 1.00 1.00 C ATOM 214 CG PRO A 86 -3.079 -5.901 7.034 1.00 1.00 C ATOM 215 CD PRO A 86 -1.735 -5.201 7.151 1.00 1.00 C ATOM 0 HA PRO A 86 -2.830 -5.223 10.251 1.00 1.00 H new ATOM 0 HB2 PRO A 86 -4.038 -7.072 8.581 1.00 1.00 H new ATOM 0 HB3 PRO A 86 -4.467 -5.373 8.609 1.00 1.00 H new ATOM 0 HG2 PRO A 86 -2.963 -6.872 6.553 1.00 1.00 H new ATOM 0 HG3 PRO A 86 -3.760 -5.318 6.414 1.00 1.00 H new ATOM 0 HD2 PRO A 86 -0.943 -5.784 6.681 1.00 1.00 H new ATOM 0 HD3 PRO A 86 -1.751 -4.229 6.659 1.00 1.00 H new ATOM 220 N MET A 87 -0.607 -7.268 9.671 1.00 1.00 N ATOM 221 CA MET A 87 0.100 -8.438 10.162 1.00 1.00 C ATOM 222 C MET A 87 1.614 -8.214 10.137 1.00 1.00 C ATOM 223 O MET A 87 2.167 -7.800 9.119 1.00 1.00 O ATOM 224 CB MET A 87 -0.251 -9.648 9.296 1.00 1.00 C ATOM 225 CG MET A 87 -0.787 -10.797 10.151 1.00 1.00 C ATOM 226 SD MET A 87 0.531 -11.500 11.128 1.00 1.00 S ATOM 227 CE MET A 87 0.000 -13.203 11.188 1.00 1.00 C ATOM 0 H MET A 87 -0.047 -6.643 9.091 1.00 1.00 H new ATOM 0 HA MET A 87 -0.205 -8.618 11.193 1.00 1.00 H new ATOM 0 HB2 MET A 87 -0.997 -9.364 8.553 1.00 1.00 H new ATOM 0 HB3 MET A 87 0.633 -9.978 8.750 1.00 1.00 H new ATOM 0 HG2 MET A 87 -1.581 -10.435 10.804 1.00 1.00 H new ATOM 0 HG3 MET A 87 -1.225 -11.563 9.511 1.00 1.00 H new ATOM 0 HE1 MET A 87 0.716 -13.787 11.765 1.00 1.00 H new ATOM 0 HE2 MET A 87 -0.981 -13.262 11.660 1.00 1.00 H new ATOM 0 HE3 MET A 87 -0.061 -13.601 10.175 1.00 1.00 H new ATOM 235 N VAL A 88 2.242 -8.499 11.269 1.00 1.00 N ATOM 236 CA VAL A 88 3.681 -8.334 11.388 1.00 1.00 C ATOM 237 C VAL A 88 4.381 -9.280 10.412 1.00 1.00 C ATOM 238 O VAL A 88 3.981 -10.434 10.265 1.00 1.00 O ATOM 239 CB VAL A 88 4.112 -8.548 12.841 1.00 1.00 C ATOM 240 CG1 VAL A 88 5.594 -8.214 13.027 1.00 1.00 C ATOM 241 CG2 VAL A 88 3.242 -7.728 13.797 1.00 1.00 C ATOM 0 H VAL A 88 1.781 -8.843 12.111 1.00 1.00 H new ATOM 0 HA VAL A 88 3.973 -7.318 11.121 1.00 1.00 H new ATOM 0 HB VAL A 88 3.972 -9.602 13.081 1.00 1.00 H new ATOM 0 HG11 VAL A 88 5.875 -8.374 14.068 1.00 1.00 H new ATOM 0 HG12 VAL A 88 6.195 -8.858 12.385 1.00 1.00 H new ATOM 0 HG13 VAL A 88 5.768 -7.172 12.760 1.00 1.00 H new ATOM 0 HG21 VAL A 88 3.569 -7.898 14.823 1.00 1.00 H new ATOM 0 HG22 VAL A 88 3.336 -6.669 13.557 1.00 1.00 H new ATOM 0 HG23 VAL A 88 2.201 -8.032 13.693 1.00 1.00 H new ATOM 251 N GLY A 89 5.414 -8.756 9.768 1.00 1.00 N ATOM 252 CA GLY A 89 6.174 -9.540 8.809 1.00 1.00 C ATOM 253 C GLY A 89 7.038 -8.638 7.926 1.00 1.00 C ATOM 254 O GLY A 89 7.829 -7.843 8.430 1.00 1.00 O ATOM 0 H GLY A 89 5.742 -7.798 9.892 1.00 1.00 H new ATOM 0 HA2 GLY A 89 6.808 -10.253 9.337 1.00 1.00 H new ATOM 0 HA3 GLY A 89 5.493 -10.120 8.186 1.00 1.00 H new ATOM 258 N THR A 90 6.858 -8.792 6.623 1.00 1.00 N ATOM 259 CA THR A 90 7.611 -8.000 5.664 1.00 1.00 C ATOM 260 C THR A 90 6.663 -7.298 4.691 1.00 1.00 C ATOM 261 O THR A 90 5.473 -7.610 4.642 1.00 1.00 O ATOM 262 CB THR A 90 8.615 -8.925 4.973 1.00 1.00 C ATOM 263 OG1 THR A 90 9.438 -9.400 6.036 1.00 1.00 O ATOM 264 CG2 THR A 90 9.581 -8.164 4.064 1.00 1.00 C ATOM 0 H THR A 90 6.202 -9.453 6.208 1.00 1.00 H new ATOM 0 HA THR A 90 8.167 -7.203 6.158 1.00 1.00 H new ATOM 0 HB THR A 90 8.078 -9.672 4.388 1.00 1.00 H new ATOM 0 HG1 THR A 90 10.117 -10.009 5.677 1.00 1.00 H new ATOM 0 HG21 THR A 90 10.272 -8.867 3.598 1.00 1.00 H new ATOM 0 HG22 THR A 90 9.018 -7.642 3.290 1.00 1.00 H new ATOM 0 HG23 THR A 90 10.143 -7.440 4.655 1.00 1.00 H new ATOM 272 N PHE A 91 7.223 -6.362 3.940 1.00 1.00 N ATOM 273 CA PHE A 91 6.443 -5.611 2.971 1.00 1.00 C ATOM 274 C PHE A 91 7.231 -5.403 1.676 1.00 1.00 C ATOM 275 O PHE A 91 8.412 -5.065 1.711 1.00 1.00 O ATOM 276 CB PHE A 91 6.143 -4.248 3.596 1.00 1.00 C ATOM 277 CG PHE A 91 5.500 -3.249 2.632 1.00 1.00 C ATOM 278 CD1 PHE A 91 6.229 -2.725 1.611 1.00 1.00 C ATOM 279 CD2 PHE A 91 4.200 -2.885 2.798 1.00 1.00 C ATOM 280 CE1 PHE A 91 5.631 -1.797 0.716 1.00 1.00 C ATOM 281 CE2 PHE A 91 3.604 -1.958 1.903 1.00 1.00 C ATOM 282 CZ PHE A 91 4.332 -1.434 0.881 1.00 1.00 C ATOM 0 H PHE A 91 8.209 -6.106 3.983 1.00 1.00 H new ATOM 0 HA PHE A 91 5.531 -6.155 2.727 1.00 1.00 H new ATOM 0 HB2 PHE A 91 5.482 -4.389 4.451 1.00 1.00 H new ATOM 0 HB3 PHE A 91 7.071 -3.823 3.978 1.00 1.00 H new ATOM 0 HD1 PHE A 91 7.261 -3.014 1.480 1.00 1.00 H new ATOM 0 HD2 PHE A 91 3.622 -3.301 3.610 1.00 1.00 H new ATOM 0 HE1 PHE A 91 6.209 -1.380 -0.095 1.00 1.00 H new ATOM 0 HE2 PHE A 91 2.572 -1.669 2.034 1.00 1.00 H new ATOM 0 HZ PHE A 91 3.878 -0.729 0.200 1.00 1.00 H new ATOM 291 N TYR A 92 6.544 -5.615 0.562 1.00 1.00 N ATOM 292 CA TYR A 92 7.164 -5.455 -0.742 1.00 1.00 C ATOM 293 C TYR A 92 6.328 -4.541 -1.639 1.00 1.00 C ATOM 294 O TYR A 92 5.153 -4.302 -1.365 1.00 1.00 O ATOM 295 CB TYR A 92 7.211 -6.853 -1.362 1.00 1.00 C ATOM 296 CG TYR A 92 8.216 -7.797 -0.697 1.00 1.00 C ATOM 297 CD1 TYR A 92 9.568 -7.627 -0.914 1.00 1.00 C ATOM 298 CD2 TYR A 92 7.770 -8.816 0.120 1.00 1.00 C ATOM 299 CE1 TYR A 92 10.514 -8.514 -0.289 1.00 1.00 C ATOM 300 CE2 TYR A 92 8.716 -9.703 0.745 1.00 1.00 C ATOM 301 CZ TYR A 92 10.041 -9.508 0.510 1.00 1.00 C ATOM 302 OH TYR A 92 10.935 -10.346 1.101 1.00 1.00 O ATOM 0 H TYR A 92 5.564 -5.896 0.536 1.00 1.00 H new ATOM 0 HA TYR A 92 8.153 -5.008 -0.643 1.00 1.00 H new ATOM 0 HB2 TYR A 92 6.218 -7.298 -1.305 1.00 1.00 H new ATOM 0 HB3 TYR A 92 7.459 -6.762 -2.420 1.00 1.00 H new ATOM 0 HD1 TYR A 92 9.916 -6.829 -1.553 1.00 1.00 H new ATOM 0 HD2 TYR A 92 6.712 -8.948 0.290 1.00 1.00 H new ATOM 0 HE1 TYR A 92 11.575 -8.393 -0.451 1.00 1.00 H new ATOM 0 HE2 TYR A 92 8.381 -10.505 1.386 1.00 1.00 H new ATOM 0 HH TYR A 92 10.455 -11.006 1.644 1.00 1.00 H new ATOM 311 N ARG A 93 6.966 -4.053 -2.692 1.00 1.00 N ATOM 312 CA ARG A 93 6.296 -3.169 -3.631 1.00 1.00 C ATOM 313 C ARG A 93 6.077 -3.882 -4.967 1.00 1.00 C ATOM 314 O ARG A 93 5.312 -3.412 -5.807 1.00 1.00 O ATOM 315 CB ARG A 93 7.110 -1.896 -3.866 1.00 1.00 C ATOM 316 CG ARG A 93 7.309 -1.123 -2.561 1.00 1.00 C ATOM 317 CD ARG A 93 6.211 -0.075 -2.372 1.00 1.00 C ATOM 318 NE ARG A 93 6.073 0.741 -3.598 1.00 1.00 N ATOM 319 CZ ARG A 93 6.996 1.631 -4.023 1.00 1.00 C ATOM 320 NH1 ARG A 93 8.133 1.827 -3.323 1.00 1.00 N ATOM 321 NH2 ARG A 93 6.768 2.306 -5.135 1.00 1.00 N ATOM 0 H ARG A 93 7.941 -4.253 -2.916 1.00 1.00 H new ATOM 0 HA ARG A 93 5.333 -2.895 -3.200 1.00 1.00 H new ATOM 0 HB2 ARG A 93 8.080 -2.154 -4.292 1.00 1.00 H new ATOM 0 HB3 ARG A 93 6.601 -1.264 -4.593 1.00 1.00 H new ATOM 0 HG2 ARG A 93 7.304 -1.816 -1.719 1.00 1.00 H new ATOM 0 HG3 ARG A 93 8.284 -0.636 -2.568 1.00 1.00 H new ATOM 0 HD2 ARG A 93 5.265 -0.565 -2.143 1.00 1.00 H new ATOM 0 HD3 ARG A 93 6.451 0.566 -1.524 1.00 1.00 H new ATOM 0 HE ARG A 93 5.228 0.624 -4.157 1.00 1.00 H new ATOM 0 HH11 ARG A 93 8.301 1.301 -2.465 1.00 1.00 H new ATOM 0 HH12 ARG A 93 8.824 2.501 -3.652 1.00 1.00 H new ATOM 0 HH21 ARG A 93 5.906 2.151 -5.658 1.00 1.00 H new ATOM 0 HH22 ARG A 93 7.454 2.982 -5.471 1.00 1.00 H new ATOM 330 N THR A 94 6.764 -5.004 -5.122 1.00 1.00 N ATOM 331 CA THR A 94 6.655 -5.786 -6.342 1.00 1.00 C ATOM 332 C THR A 94 6.327 -7.244 -6.013 1.00 1.00 C ATOM 333 O THR A 94 6.624 -7.719 -4.918 1.00 1.00 O ATOM 334 CB THR A 94 7.956 -5.618 -7.129 1.00 1.00 C ATOM 335 OG1 THR A 94 8.976 -5.734 -6.142 1.00 1.00 O ATOM 336 CG2 THR A 94 8.127 -4.200 -7.679 1.00 1.00 C ATOM 0 H THR A 94 7.398 -5.390 -4.423 1.00 1.00 H new ATOM 0 HA THR A 94 5.834 -5.434 -6.966 1.00 1.00 H new ATOM 0 HB THR A 94 7.978 -6.332 -7.952 1.00 1.00 H new ATOM 0 HG1 THR A 94 9.854 -5.639 -6.566 1.00 1.00 H new ATOM 0 HG21 THR A 94 9.066 -4.134 -8.229 1.00 1.00 H new ATOM 0 HG22 THR A 94 7.298 -3.966 -8.347 1.00 1.00 H new ATOM 0 HG23 THR A 94 8.140 -3.489 -6.853 1.00 1.00 H new ATOM 344 N PRO A 95 5.705 -7.932 -7.008 1.00 1.00 N ATOM 345 CA PRO A 95 5.335 -9.326 -6.835 1.00 1.00 C ATOM 346 C PRO A 95 6.562 -10.235 -6.928 1.00 1.00 C ATOM 347 O PRO A 95 6.780 -11.082 -6.063 1.00 1.00 O ATOM 348 CB PRO A 95 4.310 -9.599 -7.924 1.00 1.00 C ATOM 349 CG PRO A 95 4.487 -8.491 -8.950 1.00 1.00 C ATOM 350 CD PRO A 95 5.338 -7.402 -8.318 1.00 1.00 C ATOM 0 HA PRO A 95 4.915 -9.530 -5.850 1.00 1.00 H new ATOM 0 HB2 PRO A 95 4.471 -10.578 -8.375 1.00 1.00 H new ATOM 0 HB3 PRO A 95 3.299 -9.597 -7.518 1.00 1.00 H new ATOM 0 HG2 PRO A 95 4.967 -8.877 -9.849 1.00 1.00 H new ATOM 0 HG3 PRO A 95 3.519 -8.092 -9.252 1.00 1.00 H new ATOM 0 HD2 PRO A 95 6.221 -7.190 -8.921 1.00 1.00 H new ATOM 0 HD3 PRO A 95 4.783 -6.469 -8.226 1.00 1.00 H new ATOM 355 N SER A 96 7.333 -10.028 -7.986 1.00 1.00 N ATOM 356 CA SER A 96 8.533 -10.818 -8.204 1.00 1.00 C ATOM 357 C SER A 96 9.664 -9.922 -8.711 1.00 1.00 C ATOM 358 O SER A 96 9.473 -8.723 -8.900 1.00 1.00 O ATOM 359 CB SER A 96 8.271 -11.956 -9.194 1.00 1.00 C ATOM 360 OG SER A 96 6.882 -12.124 -9.459 1.00 1.00 O ATOM 0 H SER A 96 7.150 -9.324 -8.701 1.00 1.00 H new ATOM 0 HA SER A 96 8.829 -11.261 -7.253 1.00 1.00 H new ATOM 0 HB2 SER A 96 8.796 -11.753 -10.127 1.00 1.00 H new ATOM 0 HB3 SER A 96 8.679 -12.885 -8.795 1.00 1.00 H new ATOM 0 HG SER A 96 6.757 -12.858 -10.096 1.00 1.00 H new ATOM 365 N PRO A 97 10.849 -10.556 -8.921 1.00 1.00 N ATOM 366 CA PRO A 97 12.011 -9.830 -9.402 1.00 1.00 C ATOM 367 C PRO A 97 11.879 -9.509 -10.892 1.00 1.00 C ATOM 368 O PRO A 97 11.194 -10.220 -11.626 1.00 1.00 O ATOM 369 CB PRO A 97 13.195 -10.731 -9.092 1.00 1.00 C ATOM 370 CG PRO A 97 12.616 -12.120 -8.874 1.00 1.00 C ATOM 371 CD PRO A 97 11.112 -11.976 -8.707 1.00 1.00 C ATOM 0 HA PRO A 97 12.129 -8.860 -8.920 1.00 1.00 H new ATOM 0 HB2 PRO A 97 13.911 -10.731 -9.914 1.00 1.00 H new ATOM 0 HB3 PRO A 97 13.727 -10.386 -8.205 1.00 1.00 H new ATOM 0 HG2 PRO A 97 12.846 -12.767 -9.721 1.00 1.00 H new ATOM 0 HG3 PRO A 97 13.056 -12.583 -7.991 1.00 1.00 H new ATOM 0 HD2 PRO A 97 10.573 -12.591 -9.427 1.00 1.00 H new ATOM 0 HD3 PRO A 97 10.792 -12.293 -7.714 1.00 1.00 H new ATOM 376 N ASP A 98 12.546 -8.438 -11.296 1.00 1.00 N ATOM 377 CA ASP A 98 12.512 -8.013 -12.685 1.00 1.00 C ATOM 378 C ASP A 98 11.074 -7.657 -13.069 1.00 1.00 C ATOM 379 O ASP A 98 10.722 -7.668 -14.248 1.00 1.00 O ATOM 380 CB ASP A 98 12.986 -9.132 -13.614 1.00 1.00 C ATOM 381 CG ASP A 98 13.568 -8.661 -14.949 1.00 1.00 C ATOM 382 OD1 ASP A 98 12.868 -8.050 -15.771 1.00 1.00 O ATOM 383 OD2 ASP A 98 14.812 -8.948 -15.133 1.00 1.00 O ATOM 0 H ASP A 98 13.114 -7.851 -10.685 1.00 1.00 H new ATOM 0 HA ASP A 98 13.172 -7.152 -12.791 1.00 1.00 H new ATOM 0 HB2 ASP A 98 13.741 -9.721 -13.093 1.00 1.00 H new ATOM 0 HB3 ASP A 98 12.146 -9.797 -13.815 1.00 1.00 H new ATOM 388 N ALA A 99 10.282 -7.350 -12.053 1.00 1.00 N ATOM 389 CA ALA A 99 8.891 -6.992 -12.270 1.00 1.00 C ATOM 390 C ALA A 99 8.683 -5.522 -11.901 1.00 1.00 C ATOM 391 O ALA A 99 9.403 -4.980 -11.062 1.00 1.00 O ATOM 392 CB ALA A 99 7.990 -7.928 -11.461 1.00 1.00 C ATOM 0 H ALA A 99 10.577 -7.342 -11.077 1.00 1.00 H new ATOM 0 HA ALA A 99 8.625 -7.110 -13.320 1.00 1.00 H new ATOM 0 HB1 ALA A 99 6.946 -7.659 -11.624 1.00 1.00 H new ATOM 0 HB2 ALA A 99 8.154 -8.957 -11.781 1.00 1.00 H new ATOM 0 HB3 ALA A 99 8.227 -7.835 -10.401 1.00 1.00 H new ATOM 398 N LYS A 100 7.698 -4.916 -12.545 1.00 1.00 N ATOM 399 CA LYS A 100 7.388 -3.518 -12.296 1.00 1.00 C ATOM 400 C LYS A 100 6.735 -3.383 -10.918 1.00 1.00 C ATOM 401 O LYS A 100 6.290 -4.373 -10.339 1.00 1.00 O ATOM 402 CB LYS A 100 6.541 -2.945 -13.435 1.00 1.00 C ATOM 403 CG LYS A 100 6.900 -3.604 -14.769 1.00 1.00 C ATOM 404 CD LYS A 100 6.506 -2.709 -15.945 1.00 1.00 C ATOM 405 CE LYS A 100 7.630 -2.638 -16.980 1.00 1.00 C ATOM 406 NZ LYS A 100 8.087 -1.242 -17.155 1.00 1.00 N ATOM 0 H LYS A 100 7.103 -5.367 -13.240 1.00 1.00 H new ATOM 0 HA LYS A 100 8.301 -2.923 -12.278 1.00 1.00 H new ATOM 0 HB2 LYS A 100 5.484 -3.101 -13.221 1.00 1.00 H new ATOM 0 HB3 LYS A 100 6.697 -1.868 -13.503 1.00 1.00 H new ATOM 0 HG2 LYS A 100 7.971 -3.805 -14.803 1.00 1.00 H new ATOM 0 HG3 LYS A 100 6.392 -4.565 -14.852 1.00 1.00 H new ATOM 0 HD2 LYS A 100 5.600 -3.095 -16.413 1.00 1.00 H new ATOM 0 HD3 LYS A 100 6.276 -1.707 -15.583 1.00 1.00 H new ATOM 0 HE2 LYS A 100 8.465 -3.263 -16.662 1.00 1.00 H new ATOM 0 HE3 LYS A 100 7.280 -3.034 -17.933 1.00 1.00 H new ATOM 0 HZ1 LYS A 100 8.850 -1.212 -17.861 1.00 1.00 H new ATOM 0 HZ2 LYS A 100 7.292 -0.655 -17.479 1.00 1.00 H new ATOM 0 HZ3 LYS A 100 8.440 -0.876 -16.248 1.00 1.00 H new ATOM 415 N ALA A 101 6.701 -2.151 -10.434 1.00 1.00 N ATOM 416 CA ALA A 101 6.111 -1.874 -9.134 1.00 1.00 C ATOM 417 C ALA A 101 4.586 -1.920 -9.251 1.00 1.00 C ATOM 418 O ALA A 101 4.012 -1.334 -10.168 1.00 1.00 O ATOM 419 CB ALA A 101 6.616 -0.524 -8.622 1.00 1.00 C ATOM 0 H ALA A 101 7.072 -1.333 -10.917 1.00 1.00 H new ATOM 0 HA ALA A 101 6.409 -2.630 -8.408 1.00 1.00 H new ATOM 0 HB1 ALA A 101 6.174 -0.316 -7.648 1.00 1.00 H new ATOM 0 HB2 ALA A 101 7.702 -0.553 -8.529 1.00 1.00 H new ATOM 0 HB3 ALA A 101 6.333 0.260 -9.324 1.00 1.00 H new ATOM 425 N PHE A 102 3.974 -2.623 -8.310 1.00 1.00 N ATOM 426 CA PHE A 102 2.527 -2.752 -8.296 1.00 1.00 C ATOM 427 C PHE A 102 1.852 -1.399 -8.535 1.00 1.00 C ATOM 428 O PHE A 102 0.893 -1.307 -9.301 1.00 1.00 O ATOM 429 CB PHE A 102 2.137 -3.264 -6.908 1.00 1.00 C ATOM 430 CG PHE A 102 2.007 -4.787 -6.819 1.00 1.00 C ATOM 431 CD1 PHE A 102 0.946 -5.413 -7.393 1.00 1.00 C ATOM 432 CD2 PHE A 102 2.955 -5.511 -6.166 1.00 1.00 C ATOM 433 CE1 PHE A 102 0.827 -6.826 -7.310 1.00 1.00 C ATOM 434 CE2 PHE A 102 2.835 -6.925 -6.084 1.00 1.00 C ATOM 435 CZ PHE A 102 1.774 -7.551 -6.658 1.00 1.00 C ATOM 0 H PHE A 102 4.453 -3.109 -7.552 1.00 1.00 H new ATOM 0 HA PHE A 102 2.207 -3.432 -9.086 1.00 1.00 H new ATOM 0 HB2 PHE A 102 2.883 -2.931 -6.186 1.00 1.00 H new ATOM 0 HB3 PHE A 102 1.189 -2.811 -6.618 1.00 1.00 H new ATOM 0 HD1 PHE A 102 0.194 -4.837 -7.912 1.00 1.00 H new ATOM 0 HD2 PHE A 102 3.798 -5.012 -5.710 1.00 1.00 H new ATOM 0 HE1 PHE A 102 -0.016 -7.324 -7.765 1.00 1.00 H new ATOM 0 HE2 PHE A 102 3.587 -7.502 -5.566 1.00 1.00 H new ATOM 0 HZ PHE A 102 1.683 -8.625 -6.596 1.00 1.00 H new ATOM 444 N ILE A 103 2.379 -0.385 -7.866 1.00 1.00 N ATOM 445 CA ILE A 103 1.840 0.958 -7.997 1.00 1.00 C ATOM 446 C ILE A 103 2.992 1.951 -8.160 1.00 1.00 C ATOM 447 O ILE A 103 3.846 2.067 -7.282 1.00 1.00 O ATOM 448 CB ILE A 103 0.912 1.279 -6.825 1.00 1.00 C ATOM 449 CG1 ILE A 103 0.335 2.691 -6.952 1.00 1.00 C ATOM 450 CG2 ILE A 103 1.624 1.069 -5.487 1.00 1.00 C ATOM 451 CD1 ILE A 103 1.293 3.729 -6.363 1.00 1.00 C ATOM 0 H ILE A 103 3.174 -0.466 -7.232 1.00 1.00 H new ATOM 0 HA ILE A 103 1.223 1.036 -8.892 1.00 1.00 H new ATOM 0 HB ILE A 103 0.073 0.584 -6.855 1.00 1.00 H new ATOM 0 HG12 ILE A 103 0.147 2.918 -8.001 1.00 1.00 H new ATOM 0 HG13 ILE A 103 -0.625 2.743 -6.438 1.00 1.00 H new ATOM 0 HG21 ILE A 103 0.941 1.304 -4.671 1.00 1.00 H new ATOM 0 HG22 ILE A 103 1.944 0.030 -5.404 1.00 1.00 H new ATOM 0 HG23 ILE A 103 2.495 1.722 -5.432 1.00 1.00 H new ATOM 0 HD11 ILE A 103 0.860 4.724 -6.466 1.00 1.00 H new ATOM 0 HD12 ILE A 103 1.459 3.513 -5.308 1.00 1.00 H new ATOM 0 HD13 ILE A 103 2.243 3.691 -6.895 1.00 1.00 H new ATOM 462 N GLU A 104 2.978 2.645 -9.288 1.00 1.00 N ATOM 463 CA GLU A 104 4.012 3.625 -9.577 1.00 1.00 C ATOM 464 C GLU A 104 3.583 5.008 -9.084 1.00 1.00 C ATOM 465 O GLU A 104 2.599 5.566 -9.568 1.00 1.00 O ATOM 466 CB GLU A 104 4.340 3.652 -11.071 1.00 1.00 C ATOM 467 CG GLU A 104 5.801 3.272 -11.319 1.00 1.00 C ATOM 468 CD GLU A 104 6.644 4.510 -11.630 1.00 1.00 C ATOM 469 OE1 GLU A 104 7.642 4.768 -10.942 1.00 1.00 O ATOM 470 OE2 GLU A 104 6.232 5.215 -12.629 1.00 1.00 O ATOM 0 H GLU A 104 2.267 2.549 -10.013 1.00 1.00 H new ATOM 0 HA GLU A 104 4.919 3.336 -9.046 1.00 1.00 H new ATOM 0 HB2 GLU A 104 3.686 2.961 -11.603 1.00 1.00 H new ATOM 0 HB3 GLU A 104 4.146 4.647 -11.471 1.00 1.00 H new ATOM 0 HG2 GLU A 104 6.203 2.765 -10.442 1.00 1.00 H new ATOM 0 HG3 GLU A 104 5.862 2.568 -12.149 1.00 1.00 H new ATOM 476 N VAL A 105 4.343 5.524 -8.129 1.00 1.00 N ATOM 477 CA VAL A 105 4.053 6.831 -7.565 1.00 1.00 C ATOM 478 C VAL A 105 3.623 7.780 -8.686 1.00 1.00 C ATOM 479 O VAL A 105 4.406 8.078 -9.586 1.00 1.00 O ATOM 480 CB VAL A 105 5.263 7.341 -6.781 1.00 1.00 C ATOM 481 CG1 VAL A 105 4.977 8.712 -6.163 1.00 1.00 C ATOM 482 CG2 VAL A 105 5.687 6.335 -5.710 1.00 1.00 C ATOM 0 H VAL A 105 5.160 5.060 -7.731 1.00 1.00 H new ATOM 0 HA VAL A 105 3.227 6.768 -6.857 1.00 1.00 H new ATOM 0 HB VAL A 105 6.092 7.454 -7.480 1.00 1.00 H new ATOM 0 HG11 VAL A 105 5.853 9.052 -5.611 1.00 1.00 H new ATOM 0 HG12 VAL A 105 4.746 9.426 -6.953 1.00 1.00 H new ATOM 0 HG13 VAL A 105 4.128 8.635 -5.484 1.00 1.00 H new ATOM 0 HG21 VAL A 105 6.549 6.723 -5.168 1.00 1.00 H new ATOM 0 HG22 VAL A 105 4.863 6.175 -5.015 1.00 1.00 H new ATOM 0 HG23 VAL A 105 5.951 5.389 -6.183 1.00 1.00 H new ATOM 492 N GLY A 106 2.380 8.229 -8.593 1.00 1.00 N ATOM 493 CA GLY A 106 1.836 9.138 -9.587 1.00 1.00 C ATOM 494 C GLY A 106 0.668 8.496 -10.336 1.00 1.00 C ATOM 495 O GLY A 106 0.180 9.046 -11.322 1.00 1.00 O ATOM 0 H GLY A 106 1.734 7.980 -7.844 1.00 1.00 H new ATOM 0 HA2 GLY A 106 1.501 10.055 -9.102 1.00 1.00 H new ATOM 0 HA3 GLY A 106 2.616 9.418 -10.295 1.00 1.00 H new ATOM 499 N GLN A 107 0.252 7.340 -9.840 1.00 1.00 N ATOM 500 CA GLN A 107 -0.851 6.617 -10.451 1.00 1.00 C ATOM 501 C GLN A 107 -2.041 6.554 -9.490 1.00 1.00 C ATOM 502 O GLN A 107 -1.923 6.929 -8.325 1.00 1.00 O ATOM 503 CB GLN A 107 -0.417 5.213 -10.877 1.00 1.00 C ATOM 504 CG GLN A 107 -1.419 4.605 -11.860 1.00 1.00 C ATOM 505 CD GLN A 107 -0.733 3.605 -12.794 1.00 1.00 C ATOM 506 OE1 GLN A 107 -0.432 3.893 -13.940 1.00 1.00 O ATOM 507 NE2 GLN A 107 -0.505 2.417 -12.241 1.00 1.00 N ATOM 0 H GLN A 107 0.659 6.886 -9.022 1.00 1.00 H new ATOM 0 HA GLN A 107 -1.160 7.154 -11.348 1.00 1.00 H new ATOM 0 HB2 GLN A 107 0.569 5.258 -11.338 1.00 1.00 H new ATOM 0 HB3 GLN A 107 -0.329 4.573 -9.999 1.00 1.00 H new ATOM 0 HG2 GLN A 107 -2.217 4.106 -11.310 1.00 1.00 H new ATOM 0 HG3 GLN A 107 -1.884 5.397 -12.447 1.00 1.00 H new ATOM 0 HE21 GLN A 107 -0.783 2.242 -11.275 1.00 1.00 H new ATOM 0 HE22 GLN A 107 -0.052 1.681 -12.783 1.00 1.00 H new ATOM 514 N LYS A 108 -3.160 6.078 -10.016 1.00 1.00 N ATOM 515 CA LYS A 108 -4.370 5.962 -9.221 1.00 1.00 C ATOM 516 C LYS A 108 -4.671 4.483 -8.971 1.00 1.00 C ATOM 517 O LYS A 108 -4.200 3.617 -9.706 1.00 1.00 O ATOM 518 CB LYS A 108 -5.522 6.721 -9.883 1.00 1.00 C ATOM 519 CG LYS A 108 -5.950 6.040 -11.185 1.00 1.00 C ATOM 520 CD LYS A 108 -6.733 7.006 -12.076 1.00 1.00 C ATOM 521 CE LYS A 108 -8.214 6.624 -12.132 1.00 1.00 C ATOM 522 NZ LYS A 108 -8.778 6.929 -13.465 1.00 1.00 N ATOM 0 H LYS A 108 -3.254 5.768 -10.983 1.00 1.00 H new ATOM 0 HA LYS A 108 -4.231 6.429 -8.246 1.00 1.00 H new ATOM 0 HB2 LYS A 108 -6.369 6.772 -9.199 1.00 1.00 H new ATOM 0 HB3 LYS A 108 -5.216 7.747 -10.088 1.00 1.00 H new ATOM 0 HG2 LYS A 108 -5.070 5.680 -11.718 1.00 1.00 H new ATOM 0 HG3 LYS A 108 -6.564 5.168 -10.959 1.00 1.00 H new ATOM 0 HD2 LYS A 108 -6.630 8.022 -11.695 1.00 1.00 H new ATOM 0 HD3 LYS A 108 -6.314 6.999 -13.082 1.00 1.00 H new ATOM 0 HE2 LYS A 108 -8.330 5.562 -11.916 1.00 1.00 H new ATOM 0 HE3 LYS A 108 -8.765 7.167 -11.364 1.00 1.00 H new ATOM 0 HZ1 LYS A 108 -9.783 6.664 -13.486 1.00 1.00 H new ATOM 0 HZ2 LYS A 108 -8.685 7.947 -13.657 1.00 1.00 H new ATOM 0 HZ3 LYS A 108 -8.263 6.391 -14.191 1.00 1.00 H new ATOM 531 N VAL A 109 -5.455 4.239 -7.931 1.00 1.00 N ATOM 532 CA VAL A 109 -5.825 2.879 -7.575 1.00 1.00 C ATOM 533 C VAL A 109 -7.310 2.837 -7.212 1.00 1.00 C ATOM 534 O VAL A 109 -7.809 3.727 -6.524 1.00 1.00 O ATOM 535 CB VAL A 109 -4.920 2.367 -6.453 1.00 1.00 C ATOM 536 CG1 VAL A 109 -3.468 2.258 -6.926 1.00 1.00 C ATOM 537 CG2 VAL A 109 -5.027 3.256 -5.214 1.00 1.00 C ATOM 0 H VAL A 109 -5.844 4.960 -7.323 1.00 1.00 H new ATOM 0 HA VAL A 109 -5.679 2.209 -8.423 1.00 1.00 H new ATOM 0 HB VAL A 109 -5.259 1.368 -6.179 1.00 1.00 H new ATOM 0 HG11 VAL A 109 -2.846 1.892 -6.109 1.00 1.00 H new ATOM 0 HG12 VAL A 109 -3.410 1.565 -7.765 1.00 1.00 H new ATOM 0 HG13 VAL A 109 -3.113 3.239 -7.241 1.00 1.00 H new ATOM 0 HG21 VAL A 109 -4.374 2.870 -4.432 1.00 1.00 H new ATOM 0 HG22 VAL A 109 -4.727 4.272 -5.468 1.00 1.00 H new ATOM 0 HG23 VAL A 109 -6.057 3.261 -4.857 1.00 1.00 H new ATOM 547 N ASN A 110 -7.975 1.796 -7.690 1.00 1.00 N ATOM 548 CA ASN A 110 -9.394 1.628 -7.423 1.00 1.00 C ATOM 549 C ASN A 110 -9.612 0.320 -6.659 1.00 1.00 C ATOM 550 O ASN A 110 -8.884 -0.650 -6.860 1.00 1.00 O ATOM 551 CB ASN A 110 -10.193 1.553 -8.725 1.00 1.00 C ATOM 552 CG ASN A 110 -9.964 0.218 -9.434 1.00 1.00 C ATOM 553 OD1 ASN A 110 -8.875 -0.095 -9.887 1.00 1.00 O ATOM 554 ND2 ASN A 110 -11.047 -0.551 -9.505 1.00 1.00 N ATOM 0 H ASN A 110 -7.558 1.060 -8.260 1.00 1.00 H new ATOM 0 HA ASN A 110 -9.732 2.485 -6.841 1.00 1.00 H new ATOM 0 HB2 ASN A 110 -11.255 1.678 -8.512 1.00 1.00 H new ATOM 0 HB3 ASN A 110 -9.901 2.372 -9.382 1.00 1.00 H new ATOM 0 HD21 ASN A 110 -10.996 -1.463 -9.959 1.00 1.00 H new ATOM 0 HD22 ASN A 110 -11.928 -0.229 -9.105 1.00 1.00 H new ATOM 560 N VAL A 111 -10.619 0.336 -5.797 1.00 1.00 N ATOM 561 CA VAL A 111 -10.942 -0.836 -5.002 1.00 1.00 C ATOM 562 C VAL A 111 -10.806 -2.089 -5.869 1.00 1.00 C ATOM 563 O VAL A 111 -11.614 -2.317 -6.767 1.00 1.00 O ATOM 564 CB VAL A 111 -12.335 -0.683 -4.388 1.00 1.00 C ATOM 565 CG1 VAL A 111 -13.423 -1.052 -5.398 1.00 1.00 C ATOM 566 CG2 VAL A 111 -12.466 -1.516 -3.111 1.00 1.00 C ATOM 0 H VAL A 111 -11.221 1.142 -5.632 1.00 1.00 H new ATOM 0 HA VAL A 111 -10.244 -0.938 -4.171 1.00 1.00 H new ATOM 0 HB VAL A 111 -12.469 0.365 -4.119 1.00 1.00 H new ATOM 0 HG11 VAL A 111 -14.403 -0.935 -4.936 1.00 1.00 H new ATOM 0 HG12 VAL A 111 -13.350 -0.397 -6.266 1.00 1.00 H new ATOM 0 HG13 VAL A 111 -13.292 -2.087 -5.712 1.00 1.00 H new ATOM 0 HG21 VAL A 111 -13.465 -1.389 -2.695 1.00 1.00 H new ATOM 0 HG22 VAL A 111 -12.301 -2.568 -3.344 1.00 1.00 H new ATOM 0 HG23 VAL A 111 -11.725 -1.185 -2.383 1.00 1.00 H new ATOM 576 N GLY A 112 -9.777 -2.868 -5.569 1.00 1.00 N ATOM 577 CA GLY A 112 -9.524 -4.092 -6.310 1.00 1.00 C ATOM 578 C GLY A 112 -8.095 -4.116 -6.858 1.00 1.00 C ATOM 579 O GLY A 112 -7.558 -5.183 -7.151 1.00 1.00 O ATOM 0 H GLY A 112 -9.109 -2.675 -4.823 1.00 1.00 H new ATOM 0 HA2 GLY A 112 -9.683 -4.953 -5.661 1.00 1.00 H new ATOM 0 HA3 GLY A 112 -10.234 -4.177 -7.133 1.00 1.00 H new ATOM 583 N ASP A 113 -7.523 -2.927 -6.979 1.00 1.00 N ATOM 584 CA ASP A 113 -6.168 -2.800 -7.486 1.00 1.00 C ATOM 585 C ASP A 113 -5.176 -3.054 -6.350 1.00 1.00 C ATOM 586 O ASP A 113 -5.364 -2.565 -5.236 1.00 1.00 O ATOM 587 CB ASP A 113 -5.914 -1.392 -8.030 1.00 1.00 C ATOM 588 CG ASP A 113 -5.935 -1.273 -9.555 1.00 1.00 C ATOM 589 OD1 ASP A 113 -5.459 -2.167 -10.271 1.00 1.00 O ATOM 590 OD2 ASP A 113 -6.476 -0.194 -10.011 1.00 1.00 O ATOM 0 H ASP A 113 -7.973 -2.045 -6.735 1.00 1.00 H new ATOM 0 HA ASP A 113 -6.039 -3.526 -8.289 1.00 1.00 H new ATOM 0 HB2 ASP A 113 -6.666 -0.719 -7.618 1.00 1.00 H new ATOM 0 HB3 ASP A 113 -4.945 -1.048 -7.667 1.00 1.00 H new ATOM 595 N THR A 114 -4.141 -3.817 -6.669 1.00 1.00 N ATOM 596 CA THR A 114 -3.119 -4.141 -5.689 1.00 1.00 C ATOM 597 C THR A 114 -2.416 -2.869 -5.210 1.00 1.00 C ATOM 598 O THR A 114 -2.318 -1.893 -5.951 1.00 1.00 O ATOM 599 CB THR A 114 -2.167 -5.161 -6.318 1.00 1.00 C ATOM 600 OG1 THR A 114 -2.999 -6.281 -6.605 1.00 1.00 O ATOM 601 CG2 THR A 114 -1.145 -5.703 -5.316 1.00 1.00 C ATOM 0 H THR A 114 -3.988 -4.220 -7.593 1.00 1.00 H new ATOM 0 HA THR A 114 -3.556 -4.589 -4.796 1.00 1.00 H new ATOM 0 HB THR A 114 -1.645 -4.701 -7.157 1.00 1.00 H new ATOM 0 HG1 THR A 114 -2.462 -6.990 -7.017 1.00 1.00 H new ATOM 0 HG21 THR A 114 -0.494 -6.422 -5.813 1.00 1.00 H new ATOM 0 HG22 THR A 114 -0.546 -4.880 -4.927 1.00 1.00 H new ATOM 0 HG23 THR A 114 -1.666 -6.193 -4.494 1.00 1.00 H new ATOM 609 N LEU A 115 -1.945 -2.922 -3.972 1.00 1.00 N ATOM 610 CA LEU A 115 -1.254 -1.786 -3.386 1.00 1.00 C ATOM 611 C LEU A 115 0.192 -2.178 -3.077 1.00 1.00 C ATOM 612 O LEU A 115 1.109 -1.380 -3.261 1.00 1.00 O ATOM 613 CB LEU A 115 -2.022 -1.262 -2.171 1.00 1.00 C ATOM 614 CG LEU A 115 -2.651 0.125 -2.323 1.00 1.00 C ATOM 615 CD1 LEU A 115 -3.217 0.320 -3.731 1.00 1.00 C ATOM 616 CD2 LEU A 115 -3.707 0.369 -1.242 1.00 1.00 C ATOM 0 H LEU A 115 -2.028 -3.733 -3.359 1.00 1.00 H new ATOM 0 HA LEU A 115 -1.216 -0.957 -4.093 1.00 1.00 H new ATOM 0 HB2 LEU A 115 -2.812 -1.973 -1.931 1.00 1.00 H new ATOM 0 HB3 LEU A 115 -1.343 -1.240 -1.319 1.00 1.00 H new ATOM 0 HG LEU A 115 -1.869 0.872 -2.185 1.00 1.00 H new ATOM 0 HD11 LEU A 115 -3.658 1.314 -3.812 1.00 1.00 H new ATOM 0 HD12 LEU A 115 -2.415 0.218 -4.463 1.00 1.00 H new ATOM 0 HD13 LEU A 115 -3.981 -0.433 -3.923 1.00 1.00 H new ATOM 0 HD21 LEU A 115 -4.139 1.361 -1.372 1.00 1.00 H new ATOM 0 HD22 LEU A 115 -4.493 -0.382 -1.325 1.00 1.00 H new ATOM 0 HD23 LEU A 115 -3.243 0.302 -0.258 1.00 1.00 H new ATOM 627 N CYS A 116 0.351 -3.409 -2.611 1.00 1.00 N ATOM 628 CA CYS A 116 1.670 -3.916 -2.274 1.00 1.00 C ATOM 629 C CYS A 116 1.518 -5.353 -1.771 1.00 1.00 C ATOM 630 O CYS A 116 0.427 -5.921 -1.823 1.00 1.00 O ATOM 631 CB CYS A 116 2.375 -3.025 -1.251 1.00 1.00 C ATOM 632 SG CYS A 116 1.168 -2.404 -0.025 1.00 1.00 S ATOM 0 H CYS A 116 -0.412 -4.069 -2.459 1.00 1.00 H new ATOM 0 HA CYS A 116 2.303 -3.907 -3.161 1.00 1.00 H new ATOM 0 HB2 CYS A 116 3.161 -3.587 -0.747 1.00 1.00 H new ATOM 0 HB3 CYS A 116 2.856 -2.188 -1.756 1.00 1.00 H new ATOM 0 HG CYS A 116 1.718 -2.383 1.153 1.00 1.00 H new ATOM 637 N ILE A 117 2.626 -5.901 -1.295 1.00 1.00 N ATOM 638 CA ILE A 117 2.629 -7.260 -0.781 1.00 1.00 C ATOM 639 C ILE A 117 3.213 -7.265 0.633 1.00 1.00 C ATOM 640 O ILE A 117 3.907 -6.330 1.026 1.00 1.00 O ATOM 641 CB ILE A 117 3.356 -8.196 -1.750 1.00 1.00 C ATOM 642 CG1 ILE A 117 2.754 -8.108 -3.153 1.00 1.00 C ATOM 643 CG2 ILE A 117 3.368 -9.631 -1.219 1.00 1.00 C ATOM 644 CD1 ILE A 117 3.134 -9.331 -3.991 1.00 1.00 C ATOM 0 H ILE A 117 3.529 -5.428 -1.254 1.00 1.00 H new ATOM 0 HA ILE A 117 1.611 -7.642 -0.707 1.00 1.00 H new ATOM 0 HB ILE A 117 4.394 -7.872 -1.825 1.00 1.00 H new ATOM 0 HG12 ILE A 117 1.669 -8.034 -3.083 1.00 1.00 H new ATOM 0 HG13 ILE A 117 3.104 -7.201 -3.647 1.00 1.00 H new ATOM 0 HG21 ILE A 117 3.890 -10.276 -1.926 1.00 1.00 H new ATOM 0 HG22 ILE A 117 3.879 -9.659 -0.257 1.00 1.00 H new ATOM 0 HG23 ILE A 117 2.343 -9.982 -1.096 1.00 1.00 H new ATOM 0 HD11 ILE A 117 2.693 -9.243 -4.984 1.00 1.00 H new ATOM 0 HD12 ILE A 117 4.219 -9.389 -4.080 1.00 1.00 H new ATOM 0 HD13 ILE A 117 2.761 -10.234 -3.507 1.00 1.00 H new ATOM 655 N VAL A 118 2.909 -8.331 1.360 1.00 1.00 N ATOM 656 CA VAL A 118 3.393 -8.470 2.723 1.00 1.00 C ATOM 657 C VAL A 118 3.710 -9.942 2.998 1.00 1.00 C ATOM 658 O VAL A 118 2.909 -10.822 2.687 1.00 1.00 O ATOM 659 CB VAL A 118 2.376 -7.883 3.703 1.00 1.00 C ATOM 660 CG1 VAL A 118 2.541 -8.494 5.096 1.00 1.00 C ATOM 661 CG2 VAL A 118 2.482 -6.358 3.756 1.00 1.00 C ATOM 0 H VAL A 118 2.334 -9.106 1.031 1.00 1.00 H new ATOM 0 HA VAL A 118 4.316 -7.907 2.860 1.00 1.00 H new ATOM 0 HB VAL A 118 1.379 -8.136 3.343 1.00 1.00 H new ATOM 0 HG11 VAL A 118 1.806 -8.059 5.773 1.00 1.00 H new ATOM 0 HG12 VAL A 118 2.391 -9.572 5.041 1.00 1.00 H new ATOM 0 HG13 VAL A 118 3.544 -8.286 5.468 1.00 1.00 H new ATOM 0 HG21 VAL A 118 1.748 -5.967 4.460 1.00 1.00 H new ATOM 0 HG22 VAL A 118 3.483 -6.074 4.080 1.00 1.00 H new ATOM 0 HG23 VAL A 118 2.291 -5.945 2.765 1.00 1.00 H new ATOM 671 N GLU A 119 4.880 -10.163 3.580 1.00 1.00 N ATOM 672 CA GLU A 119 5.312 -11.512 3.901 1.00 1.00 C ATOM 673 C GLU A 119 4.887 -11.881 5.323 1.00 1.00 C ATOM 674 O GLU A 119 5.155 -11.139 6.267 1.00 1.00 O ATOM 675 CB GLU A 119 6.825 -11.660 3.725 1.00 1.00 C ATOM 676 CG GLU A 119 7.178 -13.028 3.137 1.00 1.00 C ATOM 677 CD GLU A 119 8.529 -12.986 2.421 1.00 1.00 C ATOM 678 OE1 GLU A 119 9.576 -13.154 3.062 1.00 1.00 O ATOM 679 OE2 GLU A 119 8.466 -12.769 1.150 1.00 1.00 O ATOM 0 H GLU A 119 5.541 -9.430 3.837 1.00 1.00 H new ATOM 0 HA GLU A 119 4.830 -12.201 3.208 1.00 1.00 H new ATOM 0 HB2 GLU A 119 7.197 -10.872 3.070 1.00 1.00 H new ATOM 0 HB3 GLU A 119 7.321 -11.535 4.688 1.00 1.00 H new ATOM 0 HG2 GLU A 119 7.207 -13.773 3.932 1.00 1.00 H new ATOM 0 HG3 GLU A 119 6.402 -13.338 2.438 1.00 1.00 H new ATOM 685 N ALA A 120 4.233 -13.028 5.433 1.00 1.00 N ATOM 686 CA ALA A 120 3.768 -13.504 6.725 1.00 1.00 C ATOM 687 C ALA A 120 3.325 -14.963 6.596 1.00 1.00 C ATOM 688 O ALA A 120 3.190 -15.480 5.487 1.00 1.00 O ATOM 689 CB ALA A 120 2.646 -12.597 7.230 1.00 1.00 C ATOM 0 H ALA A 120 4.014 -13.642 4.648 1.00 1.00 H new ATOM 0 HA ALA A 120 4.572 -13.467 7.460 1.00 1.00 H new ATOM 0 HB1 ALA A 120 2.298 -12.954 8.199 1.00 1.00 H new ATOM 0 HB2 ALA A 120 3.020 -11.578 7.332 1.00 1.00 H new ATOM 0 HB3 ALA A 120 1.819 -12.611 6.520 1.00 1.00 H new ATOM 695 N MET A 121 3.111 -15.587 7.745 1.00 1.00 N ATOM 696 CA MET A 121 2.686 -16.976 7.776 1.00 1.00 C ATOM 697 C MET A 121 3.463 -17.809 6.753 1.00 1.00 C ATOM 698 O MET A 121 2.877 -18.606 6.023 1.00 1.00 O ATOM 699 CB MET A 121 1.189 -17.059 7.469 1.00 1.00 C ATOM 700 CG MET A 121 0.886 -16.528 6.067 1.00 1.00 C ATOM 701 SD MET A 121 -0.796 -16.920 5.617 1.00 1.00 S ATOM 702 CE MET A 121 -0.713 -16.663 3.853 1.00 1.00 C ATOM 0 H MET A 121 3.224 -15.156 8.662 1.00 1.00 H new ATOM 0 HA MET A 121 2.885 -17.376 8.770 1.00 1.00 H new ATOM 0 HB2 MET A 121 0.854 -18.093 7.550 1.00 1.00 H new ATOM 0 HB3 MET A 121 0.630 -16.484 8.208 1.00 1.00 H new ATOM 0 HG2 MET A 121 1.037 -15.449 6.037 1.00 1.00 H new ATOM 0 HG3 MET A 121 1.576 -16.967 5.346 1.00 1.00 H new ATOM 0 HE1 MET A 121 -1.654 -16.239 3.502 1.00 1.00 H new ATOM 0 HE2 MET A 121 0.102 -15.977 3.623 1.00 1.00 H new ATOM 0 HE3 MET A 121 -0.537 -17.616 3.354 1.00 1.00 H new ATOM 710 N LYS A 122 4.770 -17.596 6.736 1.00 1.00 N ATOM 711 CA LYS A 122 5.634 -18.317 5.815 1.00 1.00 C ATOM 712 C LYS A 122 4.959 -18.393 4.444 1.00 1.00 C ATOM 713 O LYS A 122 4.833 -19.473 3.870 1.00 1.00 O ATOM 714 CB LYS A 122 6.009 -19.683 6.393 1.00 1.00 C ATOM 715 CG LYS A 122 7.339 -20.175 5.817 1.00 1.00 C ATOM 716 CD LYS A 122 8.520 -19.478 6.494 1.00 1.00 C ATOM 717 CE LYS A 122 9.288 -18.607 5.497 1.00 1.00 C ATOM 718 NZ LYS A 122 10.394 -19.375 4.881 1.00 1.00 N ATOM 0 H LYS A 122 5.252 -16.935 7.345 1.00 1.00 H new ATOM 0 HA LYS A 122 6.575 -17.785 5.678 1.00 1.00 H new ATOM 0 HB2 LYS A 122 6.081 -19.615 7.478 1.00 1.00 H new ATOM 0 HB3 LYS A 122 5.223 -20.404 6.170 1.00 1.00 H new ATOM 0 HG2 LYS A 122 7.422 -21.253 5.953 1.00 1.00 H new ATOM 0 HG3 LYS A 122 7.367 -19.986 4.744 1.00 1.00 H new ATOM 0 HD2 LYS A 122 8.160 -18.862 7.318 1.00 1.00 H new ATOM 0 HD3 LYS A 122 9.190 -20.224 6.922 1.00 1.00 H new ATOM 0 HE2 LYS A 122 8.611 -18.248 4.722 1.00 1.00 H new ATOM 0 HE3 LYS A 122 9.686 -17.728 6.004 1.00 1.00 H new ATOM 0 HZ1 LYS A 122 10.904 -18.769 4.207 1.00 1.00 H new ATOM 0 HZ2 LYS A 122 11.049 -19.696 5.622 1.00 1.00 H new ATOM 0 HZ3 LYS A 122 10.007 -20.200 4.380 1.00 1.00 H new ATOM 727 N MET A 123 4.544 -17.232 3.959 1.00 1.00 N ATOM 728 CA MET A 123 3.886 -17.154 2.666 1.00 1.00 C ATOM 729 C MET A 123 3.599 -15.700 2.284 1.00 1.00 C ATOM 730 O MET A 123 3.501 -14.834 3.152 1.00 1.00 O ATOM 731 CB MET A 123 2.573 -17.938 2.712 1.00 1.00 C ATOM 732 CG MET A 123 2.331 -18.681 1.397 1.00 1.00 C ATOM 733 SD MET A 123 1.912 -20.384 1.726 1.00 1.00 S ATOM 734 CE MET A 123 0.137 -20.245 1.860 1.00 1.00 C ATOM 0 H MET A 123 4.651 -16.338 4.438 1.00 1.00 H new ATOM 0 HA MET A 123 4.550 -17.584 1.916 1.00 1.00 H new ATOM 0 HB2 MET A 123 2.600 -18.650 3.537 1.00 1.00 H new ATOM 0 HB3 MET A 123 1.745 -17.256 2.906 1.00 1.00 H new ATOM 0 HG2 MET A 123 1.526 -18.201 0.841 1.00 1.00 H new ATOM 0 HG3 MET A 123 3.223 -18.632 0.772 1.00 1.00 H new ATOM 0 HE1 MET A 123 -0.144 -20.168 2.910 1.00 1.00 H new ATOM 0 HE2 MET A 123 -0.199 -19.355 1.328 1.00 1.00 H new ATOM 0 HE3 MET A 123 -0.331 -21.127 1.423 1.00 1.00 H new ATOM 742 N MET A 124 3.474 -15.478 0.983 1.00 1.00 N ATOM 743 CA MET A 124 3.200 -14.144 0.476 1.00 1.00 C ATOM 744 C MET A 124 1.747 -13.744 0.738 1.00 1.00 C ATOM 745 O MET A 124 0.849 -14.583 0.678 1.00 1.00 O ATOM 746 CB MET A 124 3.478 -14.102 -1.028 1.00 1.00 C ATOM 747 CG MET A 124 3.506 -12.661 -1.541 1.00 1.00 C ATOM 748 SD MET A 124 4.306 -12.597 -3.136 1.00 1.00 S ATOM 749 CE MET A 124 3.134 -13.527 -4.109 1.00 1.00 C ATOM 0 H MET A 124 3.557 -16.199 0.266 1.00 1.00 H new ATOM 0 HA MET A 124 3.850 -13.439 0.995 1.00 1.00 H new ATOM 0 HB2 MET A 124 4.432 -14.585 -1.239 1.00 1.00 H new ATOM 0 HB3 MET A 124 2.711 -14.666 -1.559 1.00 1.00 H new ATOM 0 HG2 MET A 124 2.490 -12.274 -1.619 1.00 1.00 H new ATOM 0 HG3 MET A 124 4.036 -12.024 -0.833 1.00 1.00 H new ATOM 0 HE1 MET A 124 3.353 -13.393 -5.168 1.00 1.00 H new ATOM 0 HE2 MET A 124 3.207 -14.584 -3.854 1.00 1.00 H new ATOM 0 HE3 MET A 124 2.125 -13.173 -3.899 1.00 1.00 H new ATOM 757 N ASN A 125 1.560 -12.464 1.023 1.00 1.00 N ATOM 758 CA ASN A 125 0.232 -11.944 1.295 1.00 1.00 C ATOM 759 C ASN A 125 0.065 -10.593 0.597 1.00 1.00 C ATOM 760 O ASN A 125 0.524 -9.569 1.100 1.00 1.00 O ATOM 761 CB ASN A 125 0.019 -11.730 2.795 1.00 1.00 C ATOM 762 CG ASN A 125 0.086 -13.057 3.553 1.00 1.00 C ATOM 763 OD1 ASN A 125 -0.916 -13.701 3.820 1.00 1.00 O ATOM 764 ND2 ASN A 125 1.319 -13.430 3.883 1.00 1.00 N ATOM 0 H ASN A 125 2.307 -11.771 1.071 1.00 1.00 H new ATOM 0 HA ASN A 125 -0.495 -12.669 0.928 1.00 1.00 H new ATOM 0 HB2 ASN A 125 0.778 -11.048 3.180 1.00 1.00 H new ATOM 0 HB3 ASN A 125 -0.949 -11.259 2.965 1.00 1.00 H new ATOM 0 HD21 ASN A 125 1.469 -14.302 4.390 1.00 1.00 H new ATOM 0 HD22 ASN A 125 2.114 -12.844 3.629 1.00 1.00 H new ATOM 770 N GLN A 126 -0.593 -10.634 -0.552 1.00 1.00 N ATOM 771 CA GLN A 126 -0.826 -9.425 -1.325 1.00 1.00 C ATOM 772 C GLN A 126 -1.899 -8.565 -0.655 1.00 1.00 C ATOM 773 O GLN A 126 -2.784 -9.087 0.021 1.00 1.00 O ATOM 774 CB GLN A 126 -1.214 -9.762 -2.766 1.00 1.00 C ATOM 775 CG GLN A 126 0.016 -10.155 -3.588 1.00 1.00 C ATOM 776 CD GLN A 126 -0.306 -11.312 -4.535 1.00 1.00 C ATOM 777 OE1 GLN A 126 -0.600 -12.423 -4.124 1.00 1.00 O ATOM 778 NE2 GLN A 126 -0.233 -10.992 -5.824 1.00 1.00 N ATOM 0 H GLN A 126 -0.972 -11.485 -0.967 1.00 1.00 H new ATOM 0 HA GLN A 126 0.102 -8.854 -1.357 1.00 1.00 H new ATOM 0 HB2 GLN A 126 -1.935 -10.579 -2.770 1.00 1.00 H new ATOM 0 HB3 GLN A 126 -1.703 -8.903 -3.225 1.00 1.00 H new ATOM 0 HG2 GLN A 126 0.364 -9.296 -4.162 1.00 1.00 H new ATOM 0 HG3 GLN A 126 0.828 -10.442 -2.920 1.00 1.00 H new ATOM 0 HE21 GLN A 126 0.019 -10.043 -6.100 1.00 1.00 H new ATOM 0 HE22 GLN A 126 -0.429 -11.696 -6.536 1.00 1.00 H new ATOM 785 N ILE A 127 -1.785 -7.262 -0.865 1.00 1.00 N ATOM 786 CA ILE A 127 -2.734 -6.325 -0.290 1.00 1.00 C ATOM 787 C ILE A 127 -3.495 -5.620 -1.416 1.00 1.00 C ATOM 788 O ILE A 127 -2.899 -4.909 -2.222 1.00 1.00 O ATOM 789 CB ILE A 127 -2.026 -5.365 0.667 1.00 1.00 C ATOM 790 CG1 ILE A 127 -0.898 -6.074 1.420 1.00 1.00 C ATOM 791 CG2 ILE A 127 -3.025 -4.705 1.621 1.00 1.00 C ATOM 792 CD1 ILE A 127 -0.505 -5.297 2.678 1.00 1.00 C ATOM 0 H ILE A 127 -1.049 -6.833 -1.426 1.00 1.00 H new ATOM 0 HA ILE A 127 -3.473 -6.853 0.313 1.00 1.00 H new ATOM 0 HB ILE A 127 -1.570 -4.570 0.077 1.00 1.00 H new ATOM 0 HG12 ILE A 127 -1.215 -7.080 1.694 1.00 1.00 H new ATOM 0 HG13 ILE A 127 -0.031 -6.180 0.768 1.00 1.00 H new ATOM 0 HG21 ILE A 127 -2.495 -4.027 2.291 1.00 1.00 H new ATOM 0 HG22 ILE A 127 -3.762 -4.144 1.046 1.00 1.00 H new ATOM 0 HG23 ILE A 127 -3.530 -5.473 2.207 1.00 1.00 H new ATOM 0 HD11 ILE A 127 0.298 -5.823 3.194 1.00 1.00 H new ATOM 0 HD12 ILE A 127 -0.165 -4.300 2.398 1.00 1.00 H new ATOM 0 HD13 ILE A 127 -1.368 -5.214 3.339 1.00 1.00 H new ATOM 803 N GLU A 128 -4.801 -5.843 -1.434 1.00 1.00 N ATOM 804 CA GLU A 128 -5.649 -5.239 -2.446 1.00 1.00 C ATOM 805 C GLU A 128 -6.284 -3.954 -1.910 1.00 1.00 C ATOM 806 O GLU A 128 -6.958 -3.973 -0.881 1.00 1.00 O ATOM 807 CB GLU A 128 -6.720 -6.223 -2.923 1.00 1.00 C ATOM 808 CG GLU A 128 -7.287 -5.801 -4.280 1.00 1.00 C ATOM 809 CD GLU A 128 -8.046 -6.954 -4.939 1.00 1.00 C ATOM 810 OE1 GLU A 128 -9.268 -7.072 -4.766 1.00 1.00 O ATOM 811 OE2 GLU A 128 -7.322 -7.747 -5.654 1.00 1.00 O ATOM 0 H GLU A 128 -5.292 -6.434 -0.763 1.00 1.00 H new ATOM 0 HA GLU A 128 -5.029 -4.983 -3.305 1.00 1.00 H new ATOM 0 HB2 GLU A 128 -6.293 -7.223 -2.999 1.00 1.00 H new ATOM 0 HB3 GLU A 128 -7.524 -6.275 -2.189 1.00 1.00 H new ATOM 0 HG2 GLU A 128 -7.954 -4.949 -4.150 1.00 1.00 H new ATOM 0 HG3 GLU A 128 -6.476 -5.475 -4.932 1.00 1.00 H new ATOM 817 N ALA A 129 -6.046 -2.869 -2.631 1.00 1.00 N ATOM 818 CA ALA A 129 -6.586 -1.577 -2.241 1.00 1.00 C ATOM 819 C ALA A 129 -8.018 -1.760 -1.736 1.00 1.00 C ATOM 820 O ALA A 129 -8.823 -2.441 -2.371 1.00 1.00 O ATOM 821 CB ALA A 129 -6.504 -0.611 -3.424 1.00 1.00 C ATOM 0 H ALA A 129 -5.486 -2.857 -3.484 1.00 1.00 H new ATOM 0 HA ALA A 129 -6.002 -1.146 -1.428 1.00 1.00 H new ATOM 0 HB1 ALA A 129 -6.909 0.358 -3.131 1.00 1.00 H new ATOM 0 HB2 ALA A 129 -5.463 -0.493 -3.726 1.00 1.00 H new ATOM 0 HB3 ALA A 129 -7.081 -1.008 -4.259 1.00 1.00 H new ATOM 827 N ASP A 130 -8.294 -1.141 -0.597 1.00 1.00 N ATOM 828 CA ASP A 130 -9.615 -1.227 0.000 1.00 1.00 C ATOM 829 C ASP A 130 -10.196 0.181 0.146 1.00 1.00 C ATOM 830 O ASP A 130 -11.177 0.381 0.863 1.00 1.00 O ATOM 831 CB ASP A 130 -9.551 -1.859 1.392 1.00 1.00 C ATOM 832 CG ASP A 130 -10.096 -3.285 1.481 1.00 1.00 C ATOM 833 OD1 ASP A 130 -10.205 -3.992 0.468 1.00 1.00 O ATOM 834 OD2 ASP A 130 -10.423 -3.671 2.668 1.00 1.00 O ATOM 0 H ASP A 130 -7.625 -0.578 -0.072 1.00 1.00 H new ATOM 0 HA ASP A 130 -10.238 -1.844 -0.647 1.00 1.00 H new ATOM 0 HB2 ASP A 130 -8.513 -1.861 1.726 1.00 1.00 H new ATOM 0 HB3 ASP A 130 -10.108 -1.230 2.086 1.00 1.00 H new ATOM 839 N LYS A 131 -9.568 1.120 -0.543 1.00 1.00 N ATOM 840 CA LYS A 131 -10.010 2.505 -0.499 1.00 1.00 C ATOM 841 C LYS A 131 -9.397 3.268 -1.674 1.00 1.00 C ATOM 842 O LYS A 131 -8.359 3.912 -1.527 1.00 1.00 O ATOM 843 CB LYS A 131 -9.699 3.123 0.866 1.00 1.00 C ATOM 844 CG LYS A 131 -10.337 4.507 0.999 1.00 1.00 C ATOM 845 CD LYS A 131 -9.610 5.347 2.050 1.00 1.00 C ATOM 846 CE LYS A 131 -10.536 5.678 3.223 1.00 1.00 C ATOM 847 NZ LYS A 131 -10.934 7.103 3.183 1.00 1.00 N ATOM 0 H LYS A 131 -8.756 0.951 -1.136 1.00 1.00 H new ATOM 0 HA LYS A 131 -11.093 2.564 -0.610 1.00 1.00 H new ATOM 0 HB2 LYS A 131 -10.068 2.471 1.657 1.00 1.00 H new ATOM 0 HB3 LYS A 131 -8.620 3.202 0.996 1.00 1.00 H new ATOM 0 HG2 LYS A 131 -10.309 5.018 0.037 1.00 1.00 H new ATOM 0 HG3 LYS A 131 -11.387 4.403 1.274 1.00 1.00 H new ATOM 0 HD2 LYS A 131 -8.736 4.806 2.413 1.00 1.00 H new ATOM 0 HD3 LYS A 131 -9.247 6.269 1.596 1.00 1.00 H new ATOM 0 HE2 LYS A 131 -11.423 5.045 3.184 1.00 1.00 H new ATOM 0 HE3 LYS A 131 -10.031 5.461 4.165 1.00 1.00 H new ATOM 0 HZ1 LYS A 131 -11.562 7.311 3.986 1.00 1.00 H new ATOM 0 HZ2 LYS A 131 -10.086 7.702 3.243 1.00 1.00 H new ATOM 0 HZ3 LYS A 131 -11.434 7.299 2.292 1.00 1.00 H new ATOM 856 N SER A 132 -10.067 3.173 -2.813 1.00 1.00 N ATOM 857 CA SER A 132 -9.602 3.849 -4.013 1.00 1.00 C ATOM 858 C SER A 132 -9.050 5.230 -3.656 1.00 1.00 C ATOM 859 O SER A 132 -9.600 5.919 -2.797 1.00 1.00 O ATOM 860 CB SER A 132 -10.725 3.976 -5.044 1.00 1.00 C ATOM 861 OG SER A 132 -11.673 4.976 -4.680 1.00 1.00 O ATOM 0 H SER A 132 -10.928 2.639 -2.931 1.00 1.00 H new ATOM 0 HA SER A 132 -8.806 3.250 -4.455 1.00 1.00 H new ATOM 0 HB2 SER A 132 -10.298 4.218 -6.017 1.00 1.00 H new ATOM 0 HB3 SER A 132 -11.232 3.017 -5.148 1.00 1.00 H new ATOM 0 HG SER A 132 -12.373 5.028 -5.364 1.00 1.00 H new ATOM 866 N GLY A 133 -7.971 5.594 -4.333 1.00 1.00 N ATOM 867 CA GLY A 133 -7.339 6.881 -4.098 1.00 1.00 C ATOM 868 C GLY A 133 -6.063 7.026 -4.929 1.00 1.00 C ATOM 869 O GLY A 133 -5.753 6.164 -5.751 1.00 1.00 O ATOM 0 H GLY A 133 -7.518 5.020 -5.044 1.00 1.00 H new ATOM 0 HA2 GLY A 133 -8.034 7.682 -4.349 1.00 1.00 H new ATOM 0 HA3 GLY A 133 -7.101 6.985 -3.039 1.00 1.00 H new ATOM 873 N THR A 134 -5.358 8.121 -4.686 1.00 1.00 N ATOM 874 CA THR A 134 -4.122 8.389 -5.403 1.00 1.00 C ATOM 875 C THR A 134 -2.931 8.353 -4.444 1.00 1.00 C ATOM 876 O THR A 134 -3.059 8.715 -3.275 1.00 1.00 O ATOM 877 CB THR A 134 -4.278 9.727 -6.128 1.00 1.00 C ATOM 878 OG1 THR A 134 -5.257 9.466 -7.131 1.00 1.00 O ATOM 879 CG2 THR A 134 -3.027 10.111 -6.922 1.00 1.00 C ATOM 0 H THR A 134 -5.618 8.833 -4.003 1.00 1.00 H new ATOM 0 HA THR A 134 -3.922 7.620 -6.149 1.00 1.00 H new ATOM 0 HB THR A 134 -4.503 10.509 -5.403 1.00 1.00 H new ATOM 0 HG1 THR A 134 -5.421 10.282 -7.648 1.00 1.00 H new ATOM 0 HG21 THR A 134 -3.190 11.068 -7.417 1.00 1.00 H new ATOM 0 HG22 THR A 134 -2.177 10.193 -6.245 1.00 1.00 H new ATOM 0 HG23 THR A 134 -2.822 9.345 -7.670 1.00 1.00 H new ATOM 887 N VAL A 135 -1.799 7.915 -4.974 1.00 1.00 N ATOM 888 CA VAL A 135 -0.585 7.826 -4.178 1.00 1.00 C ATOM 889 C VAL A 135 -0.471 9.068 -3.291 1.00 1.00 C ATOM 890 O VAL A 135 -1.108 10.086 -3.557 1.00 1.00 O ATOM 891 CB VAL A 135 0.626 7.632 -5.092 1.00 1.00 C ATOM 892 CG1 VAL A 135 0.942 8.915 -5.866 1.00 1.00 C ATOM 893 CG2 VAL A 135 1.843 7.159 -4.296 1.00 1.00 C ATOM 0 H VAL A 135 -1.696 7.618 -5.944 1.00 1.00 H new ATOM 0 HA VAL A 135 -0.622 6.958 -3.520 1.00 1.00 H new ATOM 0 HB VAL A 135 0.377 6.857 -5.817 1.00 1.00 H new ATOM 0 HG11 VAL A 135 1.807 8.749 -6.508 1.00 1.00 H new ATOM 0 HG12 VAL A 135 0.084 9.191 -6.478 1.00 1.00 H new ATOM 0 HG13 VAL A 135 1.161 9.719 -5.163 1.00 1.00 H new ATOM 0 HG21 VAL A 135 2.690 7.029 -4.969 1.00 1.00 H new ATOM 0 HG22 VAL A 135 2.093 7.901 -3.538 1.00 1.00 H new ATOM 0 HG23 VAL A 135 1.615 6.209 -3.812 1.00 1.00 H new ATOM 903 N LYS A 136 0.345 8.942 -2.255 1.00 1.00 N ATOM 904 CA LYS A 136 0.551 10.041 -1.327 1.00 1.00 C ATOM 905 C LYS A 136 2.011 10.052 -0.871 1.00 1.00 C ATOM 906 O LYS A 136 2.667 11.092 -0.899 1.00 1.00 O ATOM 907 CB LYS A 136 -0.453 9.964 -0.175 1.00 1.00 C ATOM 908 CG LYS A 136 -1.058 11.339 0.119 1.00 1.00 C ATOM 909 CD LYS A 136 -1.966 11.287 1.349 1.00 1.00 C ATOM 910 CE LYS A 136 -1.542 12.327 2.387 1.00 1.00 C ATOM 911 NZ LYS A 136 -2.719 13.075 2.882 1.00 1.00 N ATOM 0 H LYS A 136 0.871 8.096 -2.038 1.00 1.00 H new ATOM 0 HA LYS A 136 0.364 10.995 -1.819 1.00 1.00 H new ATOM 0 HB2 LYS A 136 -1.246 9.260 -0.426 1.00 1.00 H new ATOM 0 HB3 LYS A 136 0.042 9.582 0.718 1.00 1.00 H new ATOM 0 HG2 LYS A 136 -0.260 12.064 0.282 1.00 1.00 H new ATOM 0 HG3 LYS A 136 -1.629 11.681 -0.744 1.00 1.00 H new ATOM 0 HD2 LYS A 136 -2.999 11.466 1.051 1.00 1.00 H new ATOM 0 HD3 LYS A 136 -1.929 10.291 1.791 1.00 1.00 H new ATOM 0 HE2 LYS A 136 -1.040 11.834 3.220 1.00 1.00 H new ATOM 0 HE3 LYS A 136 -0.824 13.018 1.946 1.00 1.00 H new ATOM 0 HZ1 LYS A 136 -2.413 13.777 3.586 1.00 1.00 H new ATOM 0 HZ2 LYS A 136 -3.181 13.561 2.087 1.00 1.00 H new ATOM 0 HZ3 LYS A 136 -3.391 12.414 3.322 1.00 1.00 H new ATOM 920 N ALA A 137 2.477 8.881 -0.462 1.00 1.00 N ATOM 921 CA ALA A 137 3.849 8.741 0.000 1.00 1.00 C ATOM 922 C ALA A 137 4.050 7.338 0.574 1.00 1.00 C ATOM 923 O ALA A 137 3.231 6.862 1.359 1.00 1.00 O ATOM 924 CB ALA A 137 4.158 9.839 1.021 1.00 1.00 C ATOM 0 H ALA A 137 1.930 8.020 -0.441 1.00 1.00 H new ATOM 0 HA ALA A 137 4.547 8.860 -0.829 1.00 1.00 H new ATOM 0 HB1 ALA A 137 5.186 9.735 1.368 1.00 1.00 H new ATOM 0 HB2 ALA A 137 4.030 10.816 0.555 1.00 1.00 H new ATOM 0 HB3 ALA A 137 3.478 9.749 1.869 1.00 1.00 H new ATOM 930 N ILE A 138 5.142 6.714 0.158 1.00 1.00 N ATOM 931 CA ILE A 138 5.460 5.373 0.621 1.00 1.00 C ATOM 932 C ILE A 138 6.512 5.458 1.729 1.00 1.00 C ATOM 933 O ILE A 138 7.612 5.962 1.507 1.00 1.00 O ATOM 934 CB ILE A 138 5.874 4.485 -0.554 1.00 1.00 C ATOM 935 CG1 ILE A 138 5.157 4.906 -1.839 1.00 1.00 C ATOM 936 CG2 ILE A 138 5.647 3.007 -0.229 1.00 1.00 C ATOM 937 CD1 ILE A 138 5.540 3.992 -3.004 1.00 1.00 C ATOM 0 H ILE A 138 5.818 7.112 -0.494 1.00 1.00 H new ATOM 0 HA ILE A 138 4.579 4.899 1.053 1.00 1.00 H new ATOM 0 HB ILE A 138 6.942 4.618 -0.724 1.00 1.00 H new ATOM 0 HG12 ILE A 138 4.078 4.873 -1.685 1.00 1.00 H new ATOM 0 HG13 ILE A 138 5.413 5.937 -2.082 1.00 1.00 H new ATOM 0 HG21 ILE A 138 5.949 2.397 -1.080 1.00 1.00 H new ATOM 0 HG22 ILE A 138 6.239 2.731 0.644 1.00 1.00 H new ATOM 0 HG23 ILE A 138 4.591 2.839 -0.019 1.00 1.00 H new ATOM 0 HD11 ILE A 138 5.017 4.312 -3.905 1.00 1.00 H new ATOM 0 HD12 ILE A 138 6.616 4.046 -3.170 1.00 1.00 H new ATOM 0 HD13 ILE A 138 5.260 2.965 -2.768 1.00 1.00 H new ATOM 948 N LEU A 139 6.138 4.957 2.897 1.00 1.00 N ATOM 949 CA LEU A 139 7.036 4.969 4.038 1.00 1.00 C ATOM 950 C LEU A 139 7.878 3.692 4.033 1.00 1.00 C ATOM 951 O LEU A 139 9.087 3.742 4.256 1.00 1.00 O ATOM 952 CB LEU A 139 6.251 5.182 5.335 1.00 1.00 C ATOM 953 CG LEU A 139 4.823 5.709 5.176 1.00 1.00 C ATOM 954 CD1 LEU A 139 4.190 5.996 6.539 1.00 1.00 C ATOM 955 CD2 LEU A 139 4.791 6.934 4.259 1.00 1.00 C ATOM 0 H LEU A 139 5.225 4.540 3.077 1.00 1.00 H new ATOM 0 HA LEU A 139 7.728 5.808 3.969 1.00 1.00 H new ATOM 0 HB2 LEU A 139 6.210 4.234 5.871 1.00 1.00 H new ATOM 0 HB3 LEU A 139 6.807 5.879 5.962 1.00 1.00 H new ATOM 0 HG LEU A 139 4.223 4.934 4.700 1.00 1.00 H new ATOM 0 HD11 LEU A 139 3.176 6.369 6.398 1.00 1.00 H new ATOM 0 HD12 LEU A 139 4.160 5.079 7.127 1.00 1.00 H new ATOM 0 HD13 LEU A 139 4.782 6.745 7.065 1.00 1.00 H new ATOM 0 HD21 LEU A 139 3.765 7.289 4.162 1.00 1.00 H new ATOM 0 HD22 LEU A 139 5.410 7.724 4.685 1.00 1.00 H new ATOM 0 HD23 LEU A 139 5.175 6.663 3.276 1.00 1.00 H new ATOM 966 N VAL A 140 7.207 2.579 3.775 1.00 1.00 N ATOM 967 CA VAL A 140 7.880 1.292 3.738 1.00 1.00 C ATOM 968 C VAL A 140 8.549 1.110 2.374 1.00 1.00 C ATOM 969 O VAL A 140 8.183 1.776 1.406 1.00 1.00 O ATOM 970 CB VAL A 140 6.890 0.174 4.072 1.00 1.00 C ATOM 971 CG1 VAL A 140 5.770 0.105 3.031 1.00 1.00 C ATOM 972 CG2 VAL A 140 7.605 -1.172 4.199 1.00 1.00 C ATOM 0 H VAL A 140 6.205 2.542 3.590 1.00 1.00 H new ATOM 0 HA VAL A 140 8.665 1.250 4.493 1.00 1.00 H new ATOM 0 HB VAL A 140 6.437 0.404 5.036 1.00 1.00 H new ATOM 0 HG11 VAL A 140 5.080 -0.698 3.292 1.00 1.00 H new ATOM 0 HG12 VAL A 140 5.233 1.053 3.011 1.00 1.00 H new ATOM 0 HG13 VAL A 140 6.199 -0.090 2.048 1.00 1.00 H new ATOM 0 HG21 VAL A 140 6.878 -1.949 4.437 1.00 1.00 H new ATOM 0 HG22 VAL A 140 8.098 -1.412 3.257 1.00 1.00 H new ATOM 0 HG23 VAL A 140 8.349 -1.115 4.994 1.00 1.00 H new ATOM 982 N GLU A 141 9.518 0.207 2.341 1.00 1.00 N ATOM 983 CA GLU A 141 10.241 -0.070 1.112 1.00 1.00 C ATOM 984 C GLU A 141 10.044 -1.530 0.698 1.00 1.00 C ATOM 985 O GLU A 141 9.402 -2.301 1.410 1.00 1.00 O ATOM 986 CB GLU A 141 11.727 0.261 1.263 1.00 1.00 C ATOM 987 CG GLU A 141 12.290 0.856 -0.029 1.00 1.00 C ATOM 988 CD GLU A 141 13.551 0.112 -0.472 1.00 1.00 C ATOM 989 OE1 GLU A 141 14.660 0.657 -0.374 1.00 1.00 O ATOM 990 OE2 GLU A 141 13.348 -1.076 -0.932 1.00 1.00 O ATOM 0 H GLU A 141 9.819 -0.342 3.146 1.00 1.00 H new ATOM 0 HA GLU A 141 9.839 0.568 0.325 1.00 1.00 H new ATOM 0 HB2 GLU A 141 11.865 0.966 2.083 1.00 1.00 H new ATOM 0 HB3 GLU A 141 12.280 -0.642 1.523 1.00 1.00 H new ATOM 0 HG2 GLU A 141 11.537 0.804 -0.816 1.00 1.00 H new ATOM 0 HG3 GLU A 141 12.520 1.911 0.122 1.00 1.00 H new ATOM 996 N SER A 142 10.608 -1.867 -0.453 1.00 1.00 N ATOM 997 CA SER A 142 10.503 -3.220 -0.970 1.00 1.00 C ATOM 998 C SER A 142 11.485 -4.138 -0.239 1.00 1.00 C ATOM 999 O SER A 142 12.667 -4.183 -0.577 1.00 1.00 O ATOM 1000 CB SER A 142 10.764 -3.256 -2.477 1.00 1.00 C ATOM 1001 OG SER A 142 12.105 -2.894 -2.795 1.00 1.00 O ATOM 0 H SER A 142 11.139 -1.226 -1.042 1.00 1.00 H new ATOM 0 HA SER A 142 9.487 -3.574 -0.796 1.00 1.00 H new ATOM 0 HB2 SER A 142 10.559 -4.257 -2.857 1.00 1.00 H new ATOM 0 HB3 SER A 142 10.076 -2.577 -2.980 1.00 1.00 H new ATOM 0 HG SER A 142 12.719 -3.332 -2.169 1.00 1.00 H new ATOM 1006 N GLY A 143 10.959 -4.848 0.749 1.00 1.00 N ATOM 1007 CA GLY A 143 11.776 -5.761 1.530 1.00 1.00 C ATOM 1008 C GLY A 143 11.698 -5.427 3.022 1.00 1.00 C ATOM 1009 O GLY A 143 11.694 -6.323 3.863 1.00 1.00 O ATOM 0 H GLY A 143 9.978 -4.809 1.026 1.00 1.00 H new ATOM 0 HA2 GLY A 143 11.442 -6.785 1.365 1.00 1.00 H new ATOM 0 HA3 GLY A 143 12.812 -5.705 1.195 1.00 1.00 H new ATOM 1013 N GLN A 144 11.640 -4.133 3.303 1.00 1.00 N ATOM 1014 CA GLN A 144 11.562 -3.669 4.677 1.00 1.00 C ATOM 1015 C GLN A 144 10.513 -4.471 5.450 1.00 1.00 C ATOM 1016 O GLN A 144 9.534 -4.940 4.871 1.00 1.00 O ATOM 1017 CB GLN A 144 11.260 -2.170 4.734 1.00 1.00 C ATOM 1018 CG GLN A 144 12.506 -1.347 4.399 1.00 1.00 C ATOM 1019 CD GLN A 144 12.267 0.141 4.669 1.00 1.00 C ATOM 1020 OE1 GLN A 144 11.257 0.712 4.294 1.00 1.00 O ATOM 1021 NE2 GLN A 144 13.253 0.734 5.336 1.00 1.00 N ATOM 0 H GLN A 144 11.646 -3.392 2.602 1.00 1.00 H new ATOM 0 HA GLN A 144 12.532 -3.828 5.149 1.00 1.00 H new ATOM 0 HB2 GLN A 144 10.461 -1.929 4.032 1.00 1.00 H new ATOM 0 HB3 GLN A 144 10.901 -1.905 5.729 1.00 1.00 H new ATOM 0 HG2 GLN A 144 13.349 -1.698 4.994 1.00 1.00 H new ATOM 0 HG3 GLN A 144 12.772 -1.493 3.352 1.00 1.00 H new ATOM 0 HE21 GLN A 144 14.072 0.196 5.620 1.00 1.00 H new ATOM 0 HE22 GLN A 144 13.190 1.726 5.563 1.00 1.00 H new ATOM 1028 N PRO A 145 10.757 -4.605 6.781 1.00 1.00 N ATOM 1029 CA PRO A 145 9.844 -5.340 7.639 1.00 1.00 C ATOM 1030 C PRO A 145 8.579 -4.528 7.919 1.00 1.00 C ATOM 1031 O PRO A 145 8.470 -3.377 7.496 1.00 1.00 O ATOM 1032 CB PRO A 145 10.644 -5.645 8.896 1.00 1.00 C ATOM 1033 CG PRO A 145 11.814 -4.675 8.890 1.00 1.00 C ATOM 1034 CD PRO A 145 11.905 -4.062 7.502 1.00 1.00 C ATOM 0 HA PRO A 145 9.484 -6.260 7.178 1.00 1.00 H new ATOM 0 HB2 PRO A 145 10.033 -5.515 9.789 1.00 1.00 H new ATOM 0 HB3 PRO A 145 10.993 -6.678 8.896 1.00 1.00 H new ATOM 0 HG2 PRO A 145 11.670 -3.899 9.641 1.00 1.00 H new ATOM 0 HG3 PRO A 145 12.740 -5.193 9.140 1.00 1.00 H new ATOM 0 HD2 PRO A 145 11.866 -2.974 7.546 1.00 1.00 H new ATOM 0 HD3 PRO A 145 12.842 -4.328 7.012 1.00 1.00 H new ATOM 1039 N VAL A 146 7.654 -5.157 8.629 1.00 1.00 N ATOM 1040 CA VAL A 146 6.400 -4.506 8.969 1.00 1.00 C ATOM 1041 C VAL A 146 5.923 -5.012 10.332 1.00 1.00 C ATOM 1042 O VAL A 146 6.302 -6.100 10.763 1.00 1.00 O ATOM 1043 CB VAL A 146 5.375 -4.730 7.856 1.00 1.00 C ATOM 1044 CG1 VAL A 146 5.523 -3.678 6.754 1.00 1.00 C ATOM 1045 CG2 VAL A 146 5.488 -6.144 7.283 1.00 1.00 C ATOM 0 H VAL A 146 7.748 -6.111 8.978 1.00 1.00 H new ATOM 0 HA VAL A 146 6.539 -3.428 9.052 1.00 1.00 H new ATOM 0 HB VAL A 146 4.381 -4.623 8.290 1.00 1.00 H new ATOM 0 HG11 VAL A 146 4.783 -3.860 5.975 1.00 1.00 H new ATOM 0 HG12 VAL A 146 5.369 -2.685 7.176 1.00 1.00 H new ATOM 0 HG13 VAL A 146 6.523 -3.739 6.325 1.00 1.00 H new ATOM 0 HG21 VAL A 146 4.748 -6.277 6.494 1.00 1.00 H new ATOM 0 HG22 VAL A 146 6.487 -6.292 6.873 1.00 1.00 H new ATOM 0 HG23 VAL A 146 5.309 -6.872 8.074 1.00 1.00 H new ATOM 1055 N GLU A 147 5.098 -4.196 10.974 1.00 1.00 N ATOM 1056 CA GLU A 147 4.565 -4.547 12.279 1.00 1.00 C ATOM 1057 C GLU A 147 3.093 -4.141 12.378 1.00 1.00 C ATOM 1058 O GLU A 147 2.622 -3.309 11.604 1.00 1.00 O ATOM 1059 CB GLU A 147 5.387 -3.905 13.398 1.00 1.00 C ATOM 1060 CG GLU A 147 5.549 -4.864 14.579 1.00 1.00 C ATOM 1061 CD GLU A 147 6.809 -4.536 15.383 1.00 1.00 C ATOM 1062 OE1 GLU A 147 6.735 -3.802 16.379 1.00 1.00 O ATOM 1063 OE2 GLU A 147 7.893 -5.075 14.940 1.00 1.00 O ATOM 0 H GLU A 147 4.786 -3.294 10.614 1.00 1.00 H new ATOM 0 HA GLU A 147 4.632 -5.628 12.398 1.00 1.00 H new ATOM 0 HB2 GLU A 147 6.368 -3.623 13.017 1.00 1.00 H new ATOM 0 HB3 GLU A 147 4.900 -2.989 13.733 1.00 1.00 H new ATOM 0 HG2 GLU A 147 4.674 -4.801 15.226 1.00 1.00 H new ATOM 0 HG3 GLU A 147 5.603 -5.890 14.214 1.00 1.00 H new ATOM 1069 N PHE A 148 2.408 -4.745 13.336 1.00 1.00 N ATOM 1070 CA PHE A 148 1.000 -4.457 13.546 1.00 1.00 C ATOM 1071 C PHE A 148 0.792 -2.990 13.929 1.00 1.00 C ATOM 1072 O PHE A 148 1.415 -2.494 14.866 1.00 1.00 O ATOM 1073 CB PHE A 148 0.529 -5.344 14.701 1.00 1.00 C ATOM 1074 CG PHE A 148 -0.982 -5.297 14.946 1.00 1.00 C ATOM 1075 CD1 PHE A 148 -1.531 -4.247 15.612 1.00 1.00 C ATOM 1076 CD2 PHE A 148 -1.774 -6.306 14.496 1.00 1.00 C ATOM 1077 CE1 PHE A 148 -2.932 -4.203 15.839 1.00 1.00 C ATOM 1078 CE2 PHE A 148 -3.176 -6.264 14.723 1.00 1.00 C ATOM 1079 CZ PHE A 148 -3.725 -5.213 15.389 1.00 1.00 C ATOM 0 H PHE A 148 2.802 -5.434 13.977 1.00 1.00 H new ATOM 0 HA PHE A 148 0.441 -4.649 12.631 1.00 1.00 H new ATOM 0 HB2 PHE A 148 0.822 -6.374 14.497 1.00 1.00 H new ATOM 0 HB3 PHE A 148 1.044 -5.040 15.612 1.00 1.00 H new ATOM 0 HD1 PHE A 148 -0.901 -3.446 15.969 1.00 1.00 H new ATOM 0 HD2 PHE A 148 -1.338 -7.140 13.966 1.00 1.00 H new ATOM 0 HE1 PHE A 148 -3.368 -3.369 16.368 1.00 1.00 H new ATOM 0 HE2 PHE A 148 -3.805 -7.066 14.367 1.00 1.00 H new ATOM 0 HZ PHE A 148 -4.791 -5.180 15.561 1.00 1.00 H new ATOM 1088 N ASP A 149 -0.087 -2.336 13.182 1.00 1.00 N ATOM 1089 CA ASP A 149 -0.385 -0.936 13.431 1.00 1.00 C ATOM 1090 C ASP A 149 0.732 -0.069 12.844 1.00 1.00 C ATOM 1091 O ASP A 149 0.817 1.121 13.139 1.00 1.00 O ATOM 1092 CB ASP A 149 -0.466 -0.648 14.932 1.00 1.00 C ATOM 1093 CG ASP A 149 -1.278 0.592 15.309 1.00 1.00 C ATOM 1094 OD1 ASP A 149 -0.740 1.705 15.399 1.00 1.00 O ATOM 1095 OD2 ASP A 149 -2.534 0.380 15.518 1.00 1.00 O ATOM 0 H ASP A 149 -0.602 -2.750 12.405 1.00 1.00 H new ATOM 0 HA ASP A 149 -1.345 -0.708 12.967 1.00 1.00 H new ATOM 0 HB2 ASP A 149 -0.902 -1.514 15.430 1.00 1.00 H new ATOM 0 HB3 ASP A 149 0.546 -0.533 15.320 1.00 1.00 H new ATOM 1100 N GLU A 150 1.558 -0.701 12.023 1.00 1.00 N ATOM 1101 CA GLU A 150 2.665 -0.003 11.392 1.00 1.00 C ATOM 1102 C GLU A 150 2.243 0.530 10.020 1.00 1.00 C ATOM 1103 O GLU A 150 1.606 -0.181 9.244 1.00 1.00 O ATOM 1104 CB GLU A 150 3.890 -0.911 11.275 1.00 1.00 C ATOM 1105 CG GLU A 150 5.122 -0.116 10.837 1.00 1.00 C ATOM 1106 CD GLU A 150 5.685 0.706 11.998 1.00 1.00 C ATOM 1107 OE1 GLU A 150 4.924 1.386 12.704 1.00 1.00 O ATOM 1108 OE2 GLU A 150 6.961 0.621 12.158 1.00 1.00 O ATOM 0 H GLU A 150 1.483 -1.689 11.780 1.00 1.00 H new ATOM 0 HA GLU A 150 2.941 0.844 12.020 1.00 1.00 H new ATOM 0 HB2 GLU A 150 4.084 -1.391 12.234 1.00 1.00 H new ATOM 0 HB3 GLU A 150 3.691 -1.706 10.556 1.00 1.00 H new ATOM 0 HG2 GLU A 150 5.886 -0.798 10.466 1.00 1.00 H new ATOM 0 HG3 GLU A 150 4.858 0.546 10.012 1.00 1.00 H new ATOM 1114 N PRO A 151 2.625 1.809 9.759 1.00 1.00 N ATOM 1115 CA PRO A 151 2.294 2.444 8.494 1.00 1.00 C ATOM 1116 C PRO A 151 3.178 1.911 7.365 1.00 1.00 C ATOM 1117 O PRO A 151 4.369 1.677 7.562 1.00 1.00 O ATOM 1118 CB PRO A 151 2.479 3.932 8.743 1.00 1.00 C ATOM 1119 CG PRO A 151 3.349 4.043 9.984 1.00 1.00 C ATOM 1120 CD PRO A 151 3.379 2.679 10.655 1.00 1.00 C ATOM 0 HA PRO A 151 1.276 2.231 8.169 1.00 1.00 H new ATOM 0 HB2 PRO A 151 2.954 4.415 7.889 1.00 1.00 H new ATOM 0 HB3 PRO A 151 1.519 4.425 8.894 1.00 1.00 H new ATOM 0 HG2 PRO A 151 4.357 4.359 9.716 1.00 1.00 H new ATOM 0 HG3 PRO A 151 2.949 4.795 10.665 1.00 1.00 H new ATOM 0 HD2 PRO A 151 4.401 2.324 10.784 1.00 1.00 H new ATOM 0 HD3 PRO A 151 2.926 2.715 11.646 1.00 1.00 H new ATOM 1125 N LEU A 152 2.560 1.735 6.206 1.00 1.00 N ATOM 1126 CA LEU A 152 3.274 1.235 5.045 1.00 1.00 C ATOM 1127 C LEU A 152 3.337 2.330 3.978 1.00 1.00 C ATOM 1128 O LEU A 152 4.382 2.946 3.776 1.00 1.00 O ATOM 1129 CB LEU A 152 2.648 -0.070 4.551 1.00 1.00 C ATOM 1130 CG LEU A 152 2.456 -1.164 5.603 1.00 1.00 C ATOM 1131 CD1 LEU A 152 1.853 -2.424 4.982 1.00 1.00 C ATOM 1132 CD2 LEU A 152 3.768 -1.456 6.335 1.00 1.00 C ATOM 0 H LEU A 152 1.572 1.930 6.047 1.00 1.00 H new ATOM 0 HA LEU A 152 4.302 0.988 5.309 1.00 1.00 H new ATOM 0 HB2 LEU A 152 1.677 0.160 4.113 1.00 1.00 H new ATOM 0 HB3 LEU A 152 3.272 -0.469 3.751 1.00 1.00 H new ATOM 0 HG LEU A 152 1.746 -0.802 6.346 1.00 1.00 H new ATOM 0 HD11 LEU A 152 1.727 -3.185 5.752 1.00 1.00 H new ATOM 0 HD12 LEU A 152 0.883 -2.186 4.545 1.00 1.00 H new ATOM 0 HD13 LEU A 152 2.518 -2.801 4.205 1.00 1.00 H new ATOM 0 HD21 LEU A 152 3.604 -2.237 7.077 1.00 1.00 H new ATOM 0 HD22 LEU A 152 4.519 -1.788 5.618 1.00 1.00 H new ATOM 0 HD23 LEU A 152 4.117 -0.551 6.832 1.00 1.00 H new ATOM 1143 N VAL A 153 2.204 2.538 3.324 1.00 1.00 N ATOM 1144 CA VAL A 153 2.116 3.549 2.283 1.00 1.00 C ATOM 1145 C VAL A 153 0.948 4.489 2.588 1.00 1.00 C ATOM 1146 O VAL A 153 -0.066 4.066 3.139 1.00 1.00 O ATOM 1147 CB VAL A 153 2.004 2.880 0.912 1.00 1.00 C ATOM 1148 CG1 VAL A 153 2.217 3.894 -0.213 1.00 1.00 C ATOM 1149 CG2 VAL A 153 2.983 1.710 0.790 1.00 1.00 C ATOM 0 H VAL A 153 1.339 2.024 3.494 1.00 1.00 H new ATOM 0 HA VAL A 153 3.022 4.154 2.261 1.00 1.00 H new ATOM 0 HB VAL A 153 0.994 2.482 0.816 1.00 1.00 H new ATOM 0 HG11 VAL A 153 2.132 3.392 -1.177 1.00 1.00 H new ATOM 0 HG12 VAL A 153 1.462 4.677 -0.144 1.00 1.00 H new ATOM 0 HG13 VAL A 153 3.209 4.337 -0.121 1.00 1.00 H new ATOM 0 HG21 VAL A 153 2.882 1.252 -0.194 1.00 1.00 H new ATOM 0 HG22 VAL A 153 4.002 2.074 0.919 1.00 1.00 H new ATOM 0 HG23 VAL A 153 2.762 0.969 1.559 1.00 1.00 H new ATOM 1159 N VAL A 154 1.130 5.748 2.215 1.00 1.00 N ATOM 1160 CA VAL A 154 0.104 6.751 2.441 1.00 1.00 C ATOM 1161 C VAL A 154 -0.569 7.095 1.111 1.00 1.00 C ATOM 1162 O VAL A 154 0.105 7.449 0.144 1.00 1.00 O ATOM 1163 CB VAL A 154 0.709 7.971 3.138 1.00 1.00 C ATOM 1164 CG1 VAL A 154 -0.351 9.049 3.376 1.00 1.00 C ATOM 1165 CG2 VAL A 154 1.388 7.572 4.450 1.00 1.00 C ATOM 0 H VAL A 154 1.973 6.096 1.758 1.00 1.00 H new ATOM 0 HA VAL A 154 -0.668 6.364 3.105 1.00 1.00 H new ATOM 0 HB VAL A 154 1.470 8.389 2.480 1.00 1.00 H new ATOM 0 HG11 VAL A 154 0.106 9.905 3.873 1.00 1.00 H new ATOM 0 HG12 VAL A 154 -0.770 9.365 2.420 1.00 1.00 H new ATOM 0 HG13 VAL A 154 -1.145 8.646 4.005 1.00 1.00 H new ATOM 0 HG21 VAL A 154 1.810 8.458 4.925 1.00 1.00 H new ATOM 0 HG22 VAL A 154 0.654 7.117 5.116 1.00 1.00 H new ATOM 0 HG23 VAL A 154 2.184 6.856 4.245 1.00 1.00 H new ATOM 1175 N ILE A 155 -1.889 6.980 1.104 1.00 1.00 N ATOM 1176 CA ILE A 155 -2.660 7.274 -0.092 1.00 1.00 C ATOM 1177 C ILE A 155 -3.466 8.555 0.130 1.00 1.00 C ATOM 1178 O ILE A 155 -3.632 9.001 1.264 1.00 1.00 O ATOM 1179 CB ILE A 155 -3.516 6.070 -0.488 1.00 1.00 C ATOM 1180 CG1 ILE A 155 -2.676 5.011 -1.203 1.00 1.00 C ATOM 1181 CG2 ILE A 155 -4.722 6.504 -1.322 1.00 1.00 C ATOM 1182 CD1 ILE A 155 -2.946 3.617 -0.632 1.00 1.00 C ATOM 0 H ILE A 155 -2.444 6.687 1.908 1.00 1.00 H new ATOM 0 HA ILE A 155 -1.997 7.455 -0.938 1.00 1.00 H new ATOM 0 HB ILE A 155 -3.903 5.613 0.423 1.00 1.00 H new ATOM 0 HG12 ILE A 155 -2.903 5.021 -2.269 1.00 1.00 H new ATOM 0 HG13 ILE A 155 -1.618 5.251 -1.100 1.00 1.00 H new ATOM 0 HG21 ILE A 155 -5.313 5.628 -1.590 1.00 1.00 H new ATOM 0 HG22 ILE A 155 -5.336 7.193 -0.742 1.00 1.00 H new ATOM 0 HG23 ILE A 155 -4.377 7.000 -2.229 1.00 1.00 H new ATOM 0 HD11 ILE A 155 -2.336 2.884 -1.159 1.00 1.00 H new ATOM 0 HD12 ILE A 155 -2.695 3.603 0.429 1.00 1.00 H new ATOM 0 HD13 ILE A 155 -4.000 3.370 -0.759 1.00 1.00 H new ATOM 1193 N GLU A 156 -3.946 9.112 -0.973 1.00 1.00 N ATOM 1194 CA GLU A 156 -4.731 10.334 -0.913 1.00 1.00 C ATOM 1195 C GLU A 156 -6.211 10.026 -1.150 1.00 1.00 C ATOM 1196 O GLU A 156 -6.751 10.336 -2.211 1.00 1.00 O ATOM 1197 CB GLU A 156 -4.217 11.365 -1.920 1.00 1.00 C ATOM 1198 CG GLU A 156 -4.605 12.784 -1.498 1.00 1.00 C ATOM 1199 CD GLU A 156 -4.363 13.780 -2.634 1.00 1.00 C ATOM 1200 OE1 GLU A 156 -5.222 13.936 -3.514 1.00 1.00 O ATOM 1201 OE2 GLU A 156 -3.235 14.403 -2.581 1.00 1.00 O ATOM 0 H GLU A 156 -3.807 8.740 -1.912 1.00 1.00 H new ATOM 0 HA GLU A 156 -4.625 10.763 0.083 1.00 1.00 H new ATOM 0 HB2 GLU A 156 -3.133 11.290 -2.002 1.00 1.00 H new ATOM 0 HB3 GLU A 156 -4.627 11.150 -2.907 1.00 1.00 H new ATOM 0 HG2 GLU A 156 -5.655 12.806 -1.208 1.00 1.00 H new ATOM 0 HG3 GLU A 156 -4.026 13.078 -0.623 1.00 1.00 H new